|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
a time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg85Ni15 at room temperature |
|
_database_code_amcsd 0002674 |
|
4.7515 10.199 5.9696 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0938 .25 .24 |
|
O1 .7667 .0924 .25 .41 |
|
O2 .2211 .4468 .25 .43 |
|
O3 .2766 .1629 .0328 .44 |
|
Ni1 0 0 0 .260 .37 |
|
Mg1 0 0 0 .740 .37 |
|
Ni2 .9909 .2769 .25 .040 .45 |
|
Mg2 .9909 .2769 .25 .960 .45 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at room temperature |
|
_database_code_amcsd 0002675 |
|
4.7487 10.201 5.9678 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4253 .0936 .25 0.28 |
|
O1 .7664 .0924 .25 0.45 |
|
O2 .2218 .4467 .25 0.47 |
|
O3 .2765 .1626 .0324 0.49 |
|
Ni1 0 0 0 .348 0.39 |
|
Mg1 0 0 0 .652 0.39 |
|
Ni2 .9910 .2768 .25 .052 0.48 |
|
Mg2 .9910 .2768 .25 .948 0.48 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg75Ni25 at room temperature |
|
_database_code_amcsd 0002676 |
|
4.7473 10.196 5.9597 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0937 .25 0.26 |
|
O1 .7670 .0927 .25 0.42 |
|
O2 .2208 .4464 .25 0.45 |
|
O3 .2763 .1627 .0325 0.45 |
|
Ni1 0 0 0 .424 0.39 |
|
Mg1 0 0 0 .576 0.39 |
|
Ni2 .9908 .2765 .25 .076 0.45 |
|
Mg2 .9908 .2765 .25 .924 0.45 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg70Ni30 at room temperature |
|
_database_code_amcsd 0002677 |
|
4.7460 10.194 5.9568 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4255 .0936 .25 0.25 |
|
O1 .7675 .0928 .25 0.41 |
|
O2 .2206 .4463 .25 0.44 |
|
O3 .2760 .1627 .0324 0.43 |
|
Ni1 0 0 0 .495 0.39 |
|
Mg1 0 0 0 .505 0.39 |
|
Ni2 .9908 .2763 .25 .105 0.44 |
|
Mg2 .9908 .2763 .25 .895 0.44 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at room temperature |
|
_database_code_amcsd 0002678 |
|
4.7396 10.187 5.9467 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0933 .25 0.29 |
|
O1 .7677 .0931 .25 0.44 |
|
O2 .2203 .4458 .25 0.47 |
|
O3 .2756 .1624 .0316 0.48 |
|
Ni1 0 0 0 .727 0.40 |
|
Mg1 0 0 0 .273 0.40 |
|
Ni2 .9914 .2754 .25 .273 0.44 |
|
Mg2 .9914 .2754 .25 .727 0.44 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg20Ni80 at room temperature |
|
_database_code_amcsd 0002679 |
|
4.7310 10.144 5.9267 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4264 .0935 .25 0.25 |
|
O1 .7701 .0936 .25 0.38 |
|
O2 .2180 .4452 .25 0.45 |
|
O3 .2747 .1627 .0305 0.40 |
|
Ni1 0 0 0 .932 0.40 |
|
Mg1 0 0 0 .068 0.40 |
|
Ni2 .9927 .2744 .25 .668 0.40 |
|
Mg2 .9927 .2744 .25 .332 0.40 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 25 C |
|
_database_code_amcsd 0002680 |
|
4.74016 10.1874 5.94729 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4261 .0922 .25 0.05 |
|
O1 .7678 .0928 .25 0.26 |
|
O2 .2209 .4460 .25 0.28 |
|
O3 .2751 .1625 .0329 0.24 |
|
Ni1 0 0 0 .727 0.22 |
|
Mg1 0 0 0 .273 0.22 |
|
Ni2 .9919 .2758 .25 .273 0.23 |
|
Mg2 .9919 .2758 .25 .727 0.23 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 200 C |
|
_database_code_amcsd 0002681 |
|
4.74800 10.2114 5.96047 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4250 .0936 .25 0.31 |
|
O1 .7686 .0931 .25 0.54 |
|
O2 .2210 .4458 .25 0.52 |
|
O3 .2753 .1621 .0319 0.52 |
|
Ni1 0 0 0 .729 0.50 |
|
Mg1 0 0 0 .271 0.50 |
|
Ni2 .9922 .2760 .25 .271 0.49 |
|
Mg2 .9922 .2760 .25 .729 0.49 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 300 C |
|
_database_code_amcsd 0002682 |
|
4.75177 10.2259 5.96665 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4253 .0934 .25 0.37 |
|
O1 .7683 .0933 .25 0.64 |
|
O2 .2210 .4460 .25 0.61 |
|
O3 .2755 .1622 .0322 0.62 |
|
Ni1 0 0 0 .731 0.60 |
|
Mg1 0 0 0 .269 0.60 |
|
Ni2 .9918 .2761 .25 .269 0.60 |
|
Mg2 .9918 .2761 .25 .731 0.60 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 400 C |
|
_database_code_amcsd 0002683 |
|
4.75574 10.2344 5.97318 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4254 .0935 .25 0.44 |
|
O1 .7680 .0933 .25 0.74 |
|
O2 .2214 .4464 .25 0.71 |
|
O3 .2756 .1621 .0323 0.74 |
|
Ni1 0 0 0 .732 0.71 |
|
Mg1 0 0 0 .268 0.71 |
|
Ni2 .9918 .2763 .25 .268 0.70 |
|
Mg2 .9918 .2763 .25 .732 0.70 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 450 C |
|
_database_code_amcsd 0002684 |
|
4.75871 10.2407 5.97656 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4252 .0934 .25 0.49 |
|
O1 .7679 .0932 .25 0.79 |
|
O2 .2213 .4463 .25 0.75 |
|
O3 .2757 .1619 .0323 0.78 |
|
Ni1 0 0 0 .732 0.76 |
|
Mg1 0 0 0 .268 0.76 |
|
Ni2 .9916 .2765 .25 .268 0.75 |
|
Mg2 .9916 .2765 .25 .732 0.75 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 500 C |
|
_database_code_amcsd 0002685 |
|
4.75984 10.2469 5.97999 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4252 .0932 .25 0.52 |
|
O1 .7676 .0932 .25 0.85 |
|
O2 .2213 .4465 .25 0.81 |
|
O3 .2758 .1619 .0324 0.82 |
|
Ni1 0 0 0 .726 0.80 |
|
Mg1 0 0 0 .274 0.80 |
|
Ni2 .9912 .2765 .25 .274 0.84 |
|
Mg2 .9912 .2765 .25 .726 0.84 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 550 C |
|
_database_code_amcsd 0002686 |
|
4.76202 10.2534 5.98349 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4251 .0931 .25 0.54 |
|
O1 .7674 .0934 .25 0.88 |
|
O2 .2212 .4467 .25 0.86 |
|
O3 .2758 .1619 .0327 0.89 |
|
Ni1 0 0 0 .731 0.86 |
|
Mg1 0 0 0 .269 0.86 |
|
Ni2 .9912 .2766 .25 .269 0.89 |
|
Mg2 .9912 .2766 .25 .731 0.89 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 600 C |
|
_database_code_amcsd 0002687 |
|
4.76419 10.2603 5.98710 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4254 .0929 .25 0.60 |
|
O1 .7672 .0935 .25 0.94 |
|
O2 .2215 .4467 .25 0.92 |
|
O3 .2759 .1619 .0326 0.94 |
|
Ni1 0 0 0 .730 0.91 |
|
Mg1 0 0 0 .270 0.91 |
|
Ni2 .9911 .2767 .25 .270 0.95 |
|
Mg2 .9911 .2767 .25 .730 0.95 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 650 C |
|
_database_code_amcsd 0002688 |
|
4.76626 10.2672 5.99066 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4251 .0930 .25 0.63 |
|
O1 .7672 .0935 .25 1.00 |
|
O2 .2215 .4469 .25 0.98 |
|
O3 .2759 .1619 .0327 1.00 |
|
Ni1 0 0 0 .740 0.97 |
|
Mg1 0 0 0 .260 0.97 |
|
Ni2 .9907 .2768 .25 .260 1.01 |
|
Mg2 .9907 .2768 .25 .740 1.01 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 700 C |
|
_database_code_amcsd 0002689 |
|
4.76809 10.2754 5.99411 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4252 .0929 .25 0.69 |
|
O1 .7670 .0936 .25 1.08 |
|
O2 .2216 .4469 .25 1.02 |
|
O3 .2759 .1618 .0328 1.05 |
|
Ni1 0 0 0 .746 1.02 |
|
Mg1 0 0 0 .254 1.02 |
|
Ni2 .9903 .2768 .25 .254 1.09 |
|
Mg2 .9903 .2768 .25 .746 1.09 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 750 C |
|
_database_code_amcsd 0002690 |
|
4.77029 10.2835 5.99796 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4251 .0927 .25 0.73 |
|
O1 .7667 .0936 .25 1.14 |
|
O2 .2218 .4472 .25 1.11 |
|
O3 .2759 .1616 .0329 1.11 |
|
Ni1 0 0 0 .761 1.09 |
|
Mg1 0 0 0 .239 1.09 |
|
Ni2 .9899 .2771 .25 .239 1.16 |
|
Mg2 .9899 .2771 .25 .761 1.16 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 800 C |
|
_database_code_amcsd 0002691 |
|
4.77267 10.2901 6.00184 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4250 .0927 .25 0.76 |
|
O1 .7664 .0935 .25 1.21 |
|
O2 .2214 .4473 .25 1.16 |
|
O3 .2761 .1617 .0330 1.17 |
|
Ni1 0 0 0 .750 1.14 |
|
Mg1 0 0 0 .250 1.14 |
|
Ni2 .9900 .2771 .25 .250 1.22 |
|
Mg2 .9900 .2771 .25 .750 1.22 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 850 C |
|
_database_code_amcsd 0002692 |
|
4.77504 10.2960 6.00539 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4252 .0926 .25 0.81 |
|
O1 .7662 .0936 .25 1.26 |
|
O2 .2215 .4475 .25 1.22 |
|
O3 .2762 .1617 .0333 1.21 |
|
Ni1 0 0 0 .749 1.21 |
|
Mg1 0 0 0 .251 1.21 |
|
Ni2 .9895 .2774 .25 .251 1.26 |
|
Mg2 .9895 .2774 .25 .749 1.26 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 900 C |
|
_database_code_amcsd 0002693 |
|
4.77773 10.3026 6.00950 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4251 .0925 .25 0.86 |
|
O1 .7662 .0935 .25 1.36 |
|
O2 .2217 .4477 .25 1.26 |
|
O3 .2763 .1616 .0334 1.27 |
|
Ni1 0 0 0 .732 1.26 |
|
Mg1 0 0 0 .268 1.26 |
|
Ni2 .9894 .2773 .25 .268 1.38 |
|
Mg2 .9894 .2773 .25 .732 1.38 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 950 C |
|
_database_code_amcsd 0002694 |
|
4.78014 10.3088 6.01327 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4253 .0923 .25 0.90 |
|
O1 .7662 .0936 .25 1.40 |
|
O2 .2216 .4478 .25 1.36 |
|
O3 .2762 .1615 .0332 1.34 |
|
Ni1 0 0 0 .726 1.35 |
|
Mg1 0 0 0 .274 1.35 |
|
Ni2 .9892 .2773 .25 .274 1.40 |
|
Mg2 .9892 .2773 .25 .726 1.40 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 1000 C |
|
_database_code_amcsd 0002695 |
|
4.78269 10.3155 6.01747 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4250 .0924 .25 0.95 |
|
O1 .7661 .0937 .25 1.45 |
|
O2 .2218 .4481 .25 1.39 |
|
O3 .2765 .1617 .0335 1.38 |
|
Ni1 0 0 0 .720 1.39 |
|
Mg1 0 0 0 .280 1.39 |
|
Ni2 .9898 .2776 .25 .280 1.49 |
|
Mg2 .9898 .2776 .25 .720 1.49 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 1050 C |
|
_database_code_amcsd 0002696 |
|
4.78522 10.3224 6.02158 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4253 .0926 .25 0.99 |
|
O1 .7658 .0936 .25 1.51 |
|
O2 .2218 .4481 .25 1.45 |
|
O3 .2765 .1616 .0336 1.47 |
|
Ni1 0 0 0 .711 1.47 |
|
Mg1 0 0 0 .289 1.47 |
|
Ni2 .9897 .2777 .25 .289 1.57 |
|
Mg2 .9897 .2777 .25 .711 1.57 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 1100 C |
|
_database_code_amcsd 0002697 |
|
4.78795 10.3296 6.02598 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4254 .0922 .25 1.03 |
|
O1 .7660 .0939 .25 1.61 |
|
O2 .2217 .4484 .25 1.55 |
|
O3 .2765 .1616 .0337 1.52 |
|
Ni1 0 0 0 .702 1.53 |
|
Mg1 0 0 0 .298 1.53 |
|
Ni2 .9890 .2776 .25 .298 1.69 |
|
Mg2 .9890 .2776 .25 .702 1.69 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 850 C, on cooling |
|
_database_code_amcsd 0002698 |
|
4.77555 10.2926 6.00582 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4250 .0922 .25 0.79 |
|
O1 .7664 .0936 .25 1.26 |
|
O2 .2219 .4476 .25 1.22 |
|
O3 .2765 .1618 .0331 1.24 |
|
Ni1 0 0 0 .738 1.21 |
|
Mg1 0 0 0 .262 1.21 |
|
Ni2 .9903 .2772 .25 .262 1.29 |
|
Mg2 .9903 .2772 .25 .738 1.29 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 750 C, on cooling |
|
_database_code_amcsd 0002699 |
|
4.77091 10.2828 5.99795 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4247 .0928 .25 0.74 |
|
O1 .7668 .0934 .25 1.14 |
|
O2 .2216 .4471 .25 1.08 |
|
O3 .2762 .1618 .0330 1.10 |
|
Ni1 0 0 0 .737 1.06 |
|
Mg1 0 0 0 .263 1.06 |
|
Ni2 .9903 .2771 .25 .263 1.19 |
|
Mg2 .9903 .2771 .25 .737 1.19 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 650 C, on cooling |
|
_database_code_amcsd 0002700 |
|
4.76655 10.2694 5.99104 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4254 .0931 .25 0.61 |
|
O1 .7671 .0934 .25 0.98 |
|
O2 .2213 .4468 .25 1.00 |
|
O3 .2757 .1619 .0329 1.01 |
|
Ni1 0 0 0 .746 0.96 |
|
Mg1 0 0 0 .254 0.96 |
|
Ni2 .9905 .2769 .25 .254 1.02 |
|
Mg2 .9905 .2769 .25 .746 1.02 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 550 C, on cooling |
|
_database_code_amcsd 0002701 |
|
4.76218 10.2564 5.98397 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4251 .0931 .25 0.55 |
|
O1 .7674 .0933 .25 0.87 |
|
O2 .2215 .4465 .25 0.88 |
|
O3 .2758 .1619 .0328 0.90 |
|
Ni1 0 0 0 .743 0.83 |
|
Mg1 0 0 0 .257 0.83 |
|
Ni2 .9910 .2769 .25 .257 0.90 |
|
Mg2 .9910 .2769 .25 .743 0.90 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 350 C, on cooling |
|
_database_code_amcsd 0002702 |
|
4.75397 10.2317 5.97049 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4250 .0936 .25 0.42 |
|
O1 .7680 .0934 .25 0.69 |
|
O2 .2212 .4461 .25 0.66 |
|
O3 .2754 .1620 .0323 0.67 |
|
Ni1 0 0 0 .750 0.64 |
|
Mg1 0 0 0 .250 0.64 |
|
Ni2 .9914 .2763 .25 .250 0.66 |
|
Mg2 .9914 .2763 .25 .750 0.66 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg50Ni50 at T = 25 C, on cooling |
|
_database_code_amcsd 0002703 |
|
4.73717 10.1870 5.94660 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0932 .25 0.22 |
|
O1 .7679 .0932 .25 0.33 |
|
O2 .2203 .4457 .25 0.36 |
|
O3 .2756 .1625 .0318 0.36 |
|
Ni1 0 0 0 .748 0.31 |
|
Mg1 0 0 0 .252 0.31 |
|
Ni2 .9910 .2754 .25 .252 0.30 |
|
Mg2 .9910 .2754 .25 .748 0.30 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 25 C |
|
_database_code_amcsd 0002704 |
|
4.74955 10.2019 5.96718 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4258 .0939 .25 0.14 |
|
O1 .7672 .0926 .25 0.29 |
|
O2 .2223 .4466 .25 0.31 |
|
O3 .2757 .1627 .0324 0.30 |
|
Ni1 0 0 0 .347 0.23 |
|
Mg1 0 0 0 .653 0.23 |
|
Ni2 .9914 .2769 .25 .053 0.29 |
|
Mg2 .9914 .2769 .25 .947 0.29 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 200 C |
|
_database_code_amcsd 0002705 |
|
4.75769 10.2279 5.98117 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4257 .0938 .25 0.31 |
|
O1 .7667 .0926 .25 0.51 |
|
O2 .2223 .4471 .25 0.53 |
|
O3 .2762 .1625 .0328 0.54 |
|
Ni1 0 0 0 .349 0.48 |
|
Mg1 0 0 0 .651 0.48 |
|
Ni2 .9911 .2773 .25 .051 0.54 |
|
Mg2 .9911 .2773 .25 .949 0.54 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 300 C |
|
_database_code_amcsd 0002706 |
|
4.76127 10.2391 5.98720 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4254 .0937 .25 0.36 |
|
O1 .7663 .0927 .25 0.56 |
|
O2 .2223 .4474 .25 0.62 |
|
O3 .2764 .1625 .0331 0.64 |
|
Ni1 0 0 0 .351 0.58 |
|
Mg1 0 0 0 .649 0.58 |
|
Ni2 .9909 .2775 .25 .049 0.64 |
|
Mg2 .9909 .2775 .25 .951 0.64 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 400 C |
|
_database_code_amcsd 0002707 |
|
4.76517 10.2566 5.99363 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0935 .25 0.43 |
|
O1 .7660 .0927 .25 0.70 |
|
O2 .2223 .4476 .25 0.71 |
|
O3 .2765 .1624 .0332 0.74 |
|
Ni1 0 0 0 .350 0.67 |
|
Mg1 0 0 0 .650 0.67 |
|
Ni2 .9903 .2776 .25 .050 0.75 |
|
Mg2 .9903 .2776 .25 .950 0.75 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 450 C |
|
_database_code_amcsd 0002708 |
|
4.76710 10.2573 5.99691 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0932 .25 0.48 |
|
O1 .7659 .0927 .25 0.75 |
|
O2 .2223 .4478 .25 0.76 |
|
O3 .2766 .1624 .0333 0.78 |
|
Ni1 0 0 0 .349 0.73 |
|
Mg1 0 0 0 .651 0.73 |
|
Ni2 .9904 .2778 .25 .051 0.81 |
|
Mg2 .9904 .2778 .25 .949 0.81 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 500 C |
|
_database_code_amcsd 0002709 |
|
4.76919 10.2639 6.00034 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4257 .0932 .25 0.50 |
|
O1 .7658 .0927 .25 0.80 |
|
O2 .2226 .4479 .25 0.82 |
|
O3 .2769 .1625 .0334 0.85 |
|
Ni1 0 0 0 .351 0.79 |
|
Mg1 0 0 0 .649 0.79 |
|
Ni2 .9902 .2778 .25 .049 0.85 |
|
Mg2 .9902 .2778 .25 .951 0.85 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 550 C |
|
_database_code_amcsd 0002710 |
|
4.77133 10.2707 6.00390 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4255 .0931 .25 0.55 |
|
O1 .7657 .0926 .25 0.85 |
|
O2 .2224 .4481 .25 0.85 |
|
O3 .2768 .1624 .0336 0.90 |
|
Ni1 0 0 0 .352 0.84 |
|
Mg1 0 0 0 .648 0.84 |
|
Ni2 .9901 .2780 .25 .048 0.92 |
|
Mg2 .9901 .2780 .25 .952 0.92 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 600 C |
|
_database_code_amcsd 0002711 |
|
4.77346 10.2781 6.00745 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0931 .25 0.59 |
|
O1 .7653 .0923 .25 0.92 |
|
O2 .2226 .4482 .25 0.92 |
|
O3 .2769 .1623 .0336 0.95 |
|
Ni1 0 0 0 .357 0.90 |
|
Mg1 0 0 0 .643 0.90 |
|
Ni2 .9900 .2782 .25 .043 0.99 |
|
Mg2 .9900 .2782 .25 .957 0.99 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 650 C |
|
_database_code_amcsd 0002712 |
|
4.77567 10.2856 6.01107 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4254 .0928 .25 0.63 |
|
O1 .7652 .0928 .25 0.99 |
|
O2 .2227 .4483 .25 0.98 |
|
O3 .2770 .1624 .0337 1.01 |
|
Ni1 0 0 0 .358 0.96 |
|
Mg1 0 0 0 .642 0.96 |
|
Ni2 .9895 .2782 .25 .042 1.06 |
|
Mg2 .9895 .2782 .25 .958 1.06 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 700 C |
|
_database_code_amcsd 0002713 |
|
4.77799 10.2928 6.01488 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4252 .0929 .25 0.66 |
|
O1 .7651 .0926 .25 1.04 |
|
O2 .2226 .4485 .25 1.04 |
|
O3 .2770 .1623 .0338 1.05 |
|
Ni1 0 0 0 .358 1.00 |
|
Mg1 0 0 0 .642 1.00 |
|
Ni2 .9894 .2784 .25 .042 1.12 |
|
Mg2 .9894 .2784 .25 .958 1.12 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 750 C |
|
_database_code_amcsd 0002714 |
|
4.78036 10.2998 6.01881 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4253 .0928 .25 0.71 |
|
O1 .7650 .0930 .25 1.10 |
|
O2 .2227 .4486 .25 1.10 |
|
O3 .2771 .1623 .0340 1.12 |
|
Ni1 0 0 0 .358 1.07 |
|
Mg1 0 0 0 .642 1.07 |
|
Ni2 .9893 .2785 .25 .042 1.18 |
|
Mg2 .9893 .2785 .25 .958 1.18 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 800 C |
|
_database_code_amcsd 0002715 |
|
4.78256 10.3064 6.02259 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4255 .0927 .25 0.76 |
|
O1 .7647 .0927 .25 1.16 |
|
O2 .2227 .4488 .25 1.15 |
|
O3 .2772 .1623 .0341 1.18 |
|
Ni1 0 0 0 .351 1.13 |
|
Mg1 0 0 0 .649 1.13 |
|
Ni2 .9892 .2786 .25 .049 1.25 |
|
Mg2 .9892 .2786 .25 .951 1.25 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 850 C |
|
_database_code_amcsd 0002716 |
|
4.78467 10.3127 6.02620 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0926 .25 0.78 |
|
O1 .7649 .0928 .25 1.22 |
|
O2 .2226 .4492 .25 1.12 |
|
O3 .2772 .1623 .0341 1.23 |
|
Ni1 0 0 0 .345 1.20 |
|
Mg1 0 0 0 .655 1.20 |
|
Ni2 .9892 .2786 .25 .055 1.36 |
|
Mg2 .9892 .2786 .25 .945 1.36 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 900 C |
|
_database_code_amcsd 0002717 |
|
4.78701 10.3194 6.03014 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4257 .0925 .25 0.83 |
|
O1 .7644 .0928 .25 1.30 |
|
O2 .2228 .4494 .25 1.30 |
|
O3 .2773 .1621 .0341 1.31 |
|
Ni1 0 0 0 .336 1.27 |
|
Mg1 0 0 0 .664 1.27 |
|
Ni2 .9891 .2789 .25 .067 1.44 |
|
Mg2 .9891 .2789 .25 .936 1.44 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 950 C |
|
_database_code_amcsd 0002718 |
|
4.78910 10.3259 6.03362 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4257 .0925 .25 0.89 |
|
O1 .7641 .0928 .25 1.37 |
|
O2 .2228 .4495 .25 1.34 |
|
O3 .2775 .1624 .0344 1.38 |
|
Ni1 0 0 0 .337 1.34 |
|
Mg1 0 0 0 .663 1.34 |
|
Ni2 .9896 .2789 .25 .063 1.51 |
|
Mg2 .9896 .2789 .25 .937 1.51 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 1000 C |
|
_database_code_amcsd 0002719 |
|
4.79136 10.3323 6.03741 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4253 .0927 .25 0.93 |
|
O1 .7641 .0931 .25 1.44 |
|
O2 .2229 .4495 .25 1.44 |
|
O3 .2776 .1624 .0345 1.43 |
|
Ni1 0 0 0 .335 1.41 |
|
Mg1 0 0 0 .665 1.41 |
|
Ni2 .9889 .2790 .25 .065 1.57 |
|
Mg2 .9889 .2790 .25 .935 1.57 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 1100 C |
|
_database_code_amcsd 0002720 |
|
4.79608 10.3467 6.04574 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4257 .0926 .25 1.01 |
|
O1 .7639 .0929 .25 1.58 |
|
O2 .2231 .4450 .25 1.54 |
|
O3 .2778 .1622 .0347 1.59 |
|
Ni1 0 0 0 .324 1.58 |
|
Mg1 0 0 0 .676 1.58 |
|
Ni2 .9891 .2791 .25 .076 1.72 |
|
Mg2 .9891 .2791 .25 .924 1.72 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 300 C, on cooling |
|
_database_code_amcsd 0002721 |
|
4.75898 10.2340 5.98423 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4259 .0937 .25 0.37 |
|
O1 .7664 .0926 .25 0.60 |
|
O2 .2222 .4474 .25 0.60 |
|
O3 .2763 .1625 .0332 0.64 |
|
Ni1 0 0 0 .349 0.58 |
|
Mg1 0 0 0 .651 0.58 |
|
Ni2 .9910 .2775 .25 .051 0.63 |
|
Mg2 .9910 .2775 .25 .949 0.63 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Olivine |
| |
Henderson C M B, Redfern S A T, Smith R I, Knight K S, Charnock J M |
 |
American Mineralogist 86 (2001) 1170-1187 |
|
Composition and temperature dependence of cation ordering in Ni-Mg olivine solid solutions: |
|
A time-of-flight neutron powder diffraction and EXAFS study |
|
Sample: Mg80Ni20 at T = 25 C, on cooling |
|
_database_code_amcsd 0002722 |
|
4.74737 10.2069 5.96790 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
Si .4256 .0937 .25 0.21 |
|
O1 .7666 .0926 .25 0.35 |
|
O2 .2219 .4467 .25 0.38 |
|
O3 .2765 .1627 .0324 0.37 |
|
Ni1 0 0 0 .349 0.32 |
|
Mg1 0 0 0 .651 0.32 |
|
Ni2 .9908 .2767 .25 .051 0.34 |
|
Mg2 .9908 .2767 .25 .949 0.34 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 20 C |
|
_database_code_amcsd 0006655 |
|
4.86145 10.5839 6.16980 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .674 .37 |
|
MnM1 0 0 0 .326 .37 |
|
MnM2 .970 .2821 .25 .674 .37 |
|
FeM2 .970 .2821 .25 .326 .37 |
|
Si .4272 .0963 .25 .22 |
|
O1 .7631 .0923 .25 .55 |
|
O2 .2135 .4540 .25 .52 |
|
O3 .2872 .1638 .0385 .50 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 100 C |
|
_database_code_amcsd 0006656 |
|
4.86394 10.5915 6.17510 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .673 .51 |
|
MnM1 0 0 0 .327 .51 |
|
MnM2 .972 .2850 .25 .673 .51 |
|
FeM2 .972 .2850 .25 .327 .51 |
|
Si .4275 .0965 .25 .38 |
|
O1 .7622 .0924 .25 .73 |
|
O2 .2132 .4538 .25 .72 |
|
O3 .2875 .1641 .0389 .71 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 200 C |
|
_database_code_amcsd 0006657 |
|
4.86743 10.6011 6.18226 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .671 .70 |
|
MnM1 0 0 0 .329 .70 |
|
MnM2 .975 .2846 .25 .671 .70 |
|
FeM2 .975 .2846 .25 .329 .70 |
|
Si .4274 .0965 .25 .47 |
|
O1 .7625 .0925 .25 .87 |
|
O2 .2131 .4542 .25 .88 |
|
O3 .2879 .1639 .0390 .88 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 300 C |
|
_database_code_amcsd 0006658 |
|
4.87189 10.6134 6.1905 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .674 .79 |
|
MnM1 0 0 0 .326 .79 |
|
MnM2 .969 .2863 .25 .674 .79 |
|
FeM2 .969 .2863 .25 .326 .79 |
|
Si .4265 .0963 .25 .57 |
|
O1 .7623 .0932 .25 1.08 |
|
O2 .2134 .4543 .25 1.07 |
|
O3 .2873 .1641 .0392 .99 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 400 C |
|
_database_code_amcsd 0006659 |
|
4.87650 10.6249 6.19849 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .674 .94 |
|
MnM1 0 0 0 .326 .94 |
|
MnM2 .969 .2877 .25 .674 .94 |
|
FeM2 .969 .2877 .25 .326 .94 |
|
Si .4274 .0963 .25 .64 |
|
O1 .7619 .0934 .25 1.22 |
|
O2 .2132 .4546 .25 1.26 |
|
O3 .2877 .1641 .0393 1.19 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 450 C |
|
_database_code_amcsd 0006660 |
|
4.87826 10.6312 6.20213 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .679 1.12 |
|
MnM1 0 0 0 .321 1.12 |
|
MnM2 .965 .2889 .25 .679 1.12 |
|
FeM2 .965 .2889 .25 .321 1.12 |
|
Si .4270 .0965 .25 .73 |
|
O1 .7613 .0931 .25 1.32 |
|
O2 .2138 .4548 .25 1.40 |
|
O3 .2876 .1639 .0397 1.27 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 550 C |
|
_database_code_amcsd 0006661 |
|
4.88292 10.6447 6.21066 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .685 1.28 |
|
MnM1 0 0 0 .315 1.28 |
|
MnM2 .957 .2921 .25 .685 1.28 |
|
FeM2 .957 .2921 .25 .315 1.28 |
|
Si .4262 .0962 .25 .87 |
|
O1 .7622 .0934 .25 1.51 |
|
O2 .2135 .4547 .25 1.57 |
|
O3 .2874 .1641 .0403 1.46 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 600 C |
|
_database_code_amcsd 0006662 |
|
4.88544 10.6499 6.21456 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .674 1.37 |
|
MnM1 0 0 0 .326 1.37 |
|
MnM2 .965 .2907 .25 .674 1.37 |
|
FeM2 .965 .2907 .25 .326 1.37 |
|
Si .4270 .0965 .25 .97 |
|
O1 .7612 .0939 .25 1.63 |
|
O2 .2134 .4548 .25 1.73 |
|
O3 .2878 .1642 .0401 1.57 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 650 C |
|
_database_code_amcsd 0006663 |
|
4.88766 10.6543 6.21842 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .664 1.45 |
|
MnM1 0 0 0 .336 1.45 |
|
MnM2 .963 .2909 .25 .664 1.45 |
|
FeM2 .963 .2909 .25 .336 1.45 |
|
Si .4267 .0964 .25 1.03 |
|
O1 .7613 .0938 .25 1.71 |
|
O2 .2132 .4552 .25 1.76 |
|
O3 .2882 .1642 .0403 1.67 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 700 C |
|
_database_code_amcsd 0006664 |
|
4.89032 10.6595 6.22274 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .659 1.66 |
|
MnM1 0 0 0 .341 1.66 |
|
MnM2 .970 .2881 .25 .659 1.66 |
|
FeM2 .970 .2881 .25 .341 1.66 |
|
Si .4267 .0965 .25 1.05 |
|
O1 .7616 .0940 .25 1.85 |
|
O2 .2131 .4552 .25 1.89 |
|
O3 .2880 .1645 .0403 1.80 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 750 degree C |
|
_database_code_amcsd 0006665 |
|
4.89292 10.6653 6.2270 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .652 1.74 |
|
MnM1 0 0 0 .348 1.74 |
|
MnM2 .976 .2873 .25 .652 1.74 |
|
FeM2 .976 .2873 .25 .348 1.74 |
|
Si .4271 .0969 .25 1.14 |
|
O1 .7614 .0969 .25 1.87 |
|
O2 .2133 .4554 .25 2.01 |
|
O3 .2886 .1646 .0404 1.93 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 800 C |
|
_database_code_amcsd 0006666 |
|
4.89570 10.6711 6.2309 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .647 1.84 |
|
MnM1 0 0 0 .353 1.84 |
|
MnM2 .978 .2888 .25 .647 1.84 |
|
FeM2 .978 .2888 .25 .353 1.84 |
|
Si .4269 .0965 .25 1.17 |
|
O1 .7611 .0938 .25 2.03 |
|
O2 .2137 .4555 .25 2.09 |
|
O3 .2883 .1646 .0408 1.98 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 850 C |
|
_database_code_amcsd 0006667 |
|
4.89828 10.6766 6.2354 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .641 1.99 |
|
MnM1 0 0 0 .359 1.99 |
|
MnM2 .976 .2881 .25 .641 1.99 |
|
FeM2 .976 .2881 .25 .359 1.99 |
|
Si .4274 .0965 .25 1.32 |
|
O1 .7617 .0942 .25 2.10 |
|
O2 .2131 .4556 .25 2.30 |
|
O3 .2887 .1646 .0412 2.16 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 900 C |
|
_database_code_amcsd 0006668 |
|
4.9010 10.6834 6.2399 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .638 2.18 |
|
MnM1 0 0 0 .362 2.18 |
|
MnM2 .975 .2868 .25 .638 2.18 |
|
FeM2 .975 .2868 .25 .362 2.18 |
|
Si .4284 .0968 .25 1.33 |
|
O1 .7618 .0945 .25 2.33 |
|
O2 .2135 .4556 .25 2.39 |
|
O3 .2892 .1649 .0413 2.30 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 950 C |
|
_database_code_amcsd 0006669 |
|
4.9041 10.6899 6.2441 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .630 2.27 |
|
MnM1 0 0 0 .370 2.27 |
|
MnM2 .972 .2874 .25 .630 2.27 |
|
FeM2 .972 .2874 .25 .370 2.27 |
|
Si .4283 .0962 .25 1.37 |
|
O1 .7616 .0941 .25 2.32 |
|
O2 .2129 .4560 .25 2.47 |
|
O3 .2888 .1647 .0409 2.37 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 1000 C |
|
_database_code_amcsd 0006670 |
|
4.9067 10.6964 6.2491 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .621 2.5 |
|
MnM1 0 0 0 .379 2.5 |
|
MnM2 .985 .2894 .25 .621 2.5 |
|
FeM2 .985 .2894 .25 .379 2.5 |
|
Si .4278 .0963 .25 1.63 |
|
O1 .7625 .0942 .25 2.44 |
|
O2 .2127 .4562 .25 2.71 |
|
O3 .2895 .1651 .0417 2.57 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 800 C, Data collected on cooling |
|
_database_code_amcsd 0006671 |
|
4.8957 10.6710 6.2316 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .646 2.1 |
|
MnM1 0 0 0 .354 2.1 |
|
MnM2 .976 .2850 .25 .646 2.1 |
|
FeM2 .976 .2850 .25 .354 2.1 |
|
Si .4279 .0961 .25 1.18 |
|
O1 .7615 .0938 .25 2.03 |
|
O2 .2130 .4558 .25 2.08 |
|
O3 .2884 .1643 .0408 2.05 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 600 C, Data collected on cooling |
|
_database_code_amcsd 0006672 |
|
4.8850 10.6490 6.2141 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .674 1.35 |
|
MnM1 0 0 0 .326 1.35 |
|
MnM2 .964 .2876 .25 .674 1.35 |
|
FeM2 .964 .2876 .25 .326 1.35 |
|
Si .4269 .0957 .25 .98 |
|
O1 .7624 .0936 .25 1.65 |
|
O2 .2122 .4552 .25 1.67 |
|
O3 .2880 .1642 .0402 1.62 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 550 C, Data collected on cooling |
|
_database_code_amcsd 0006673 |
|
4.8824 10.6432 6.2103 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .687 1.27 |
|
MnM1 0 0 0 .313 1.27 |
|
MnM2 .982 .2876 .25 .687 1.27 |
|
FeM2 .982 .2876 .25 .313 1.27 |
|
Si .4264 .0968 .25 .83 |
|
O1 .7623 .0943 .25 1.50 |
|
O2 .2138 .4546 .25 1.68 |
|
O3 .2877 .1646 .0404 1.40 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 500 C, Data collected on cooling |
|
_database_code_amcsd 0006674 |
|
4.8798 10.6376 6.2060 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .691 1.12 |
|
MnM1 0 0 0 .309 1.12 |
|
MnM2 .966 .2904 .25 .691 1.12 |
|
FeM2 .966 .2904 .25 .309 1.12 |
|
Si .4269 .0962 .25 .79 |
|
O1 .7609 .0936 .25 1.41 |
|
O2 .2146 .4549 .25 1.50 |
|
O3 .2879 .1643 .0401 1.33 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 450 C, Data collected on cooling |
|
_database_code_amcsd 0006675 |
|
4.8776 10.6325 6.2019 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .692 1.14 |
|
MnM1 0 0 0 .308 1.14 |
|
MnM2 .979 .2882 .25 .692 1.14 |
|
FeM2 .979 .2882 .25 .308 1.14 |
|
Si .4264 .0962 .25 .66 |
|
O1 .7615 .0932 .25 1.29 |
|
O2 .2138 .4547 .25 1.45 |
|
O3 .2879 .1641 .0403 1.22 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 400 C, Data collected on cooling |
|
_database_code_amcsd 0006676 |
|
4.8754 10.6260 6.1980 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .692 1.03 |
|
MnM1 0 0 0 .308 1.03 |
|
MnM2 .971 .2859 .25 .692 1.03 |
|
FeM2 .971 .2859 .25 .308 1.03 |
|
Si .4277 .0963 .25 .65 |
|
O1 .7622 .0929 .25 1.22 |
|
O2 .2133 .4545 .25 1.26 |
|
O3 .2877 .1638 .0400 1.20 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
FeMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Data collected at ISIS, Rutherford Appleton Laboratory |
|
Sample: T = 200 C, Data collected on cooling |
|
_database_code_amcsd 0006677 |
|
4.8671 10.6043 6.1828 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
FeM1 0 0 0 .689 .67 |
|
MnM1 0 0 0 .311 .67 |
|
MnM2 .965 .2861 .25 .689 .67 |
|
FeM2 .965 .2861 .25 .311 .67 |
|
Si .4280 .0961 .25 .44 |
|
O1 .7619 .0921 .25 .90 |
|
O2 .2135 .4542 .25 .93 |
|
O3 .2882 .1637 .0395 .89 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 20 C |
|
_database_code_amcsd 0006678 |
|
4.81694 10.4740 6.13964 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .732 .46 |
|
MnM1 0 0 0 .268 .46 |
|
MnM2 .9801 .2759 .25 .732 .46 |
|
MgM2 .9801 .2759 .25 .268 .46 |
|
Si .4224 .0934 .25 .53 |
|
O1 .7603 .0895 .25 .76 |
|
O2 .2255 .4501 .25 .68 |
|
O3 .2790 .1611 .0375 .75 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 200 C |
|
_database_code_amcsd 0006679 |
|
4.82397 10.4977 6.1515 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .732 .75 |
|
MnM1 0 0 0 .268 .75 |
|
MnM2 .9817 .2769 .25 .732 .75 |
|
MgM2 .9817 .2769 .25 .268 .75 |
|
Si .4225 .0930 .25 .62 |
|
O1 .7598 .0897 .25 1.02 |
|
O2 .2257 .4507 .25 .91 |
|
O3 .2793 .1612 .0377 1.07 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 300 C |
|
_database_code_amcsd 0006680 |
|
4.82822 10.5114 6.1582 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .739 .98 |
|
MnM1 0 0 0 .261 .98 |
|
MnM2 .9806 .2783 .25 .739 .98 |
|
MgM2 .9806 .2783 .25 .261 .98 |
|
Si .4231 .0936 .25 .71 |
|
O1 .7601 .0897 .25 1.22 |
|
O2 .2255 .4509 .25 1.13 |
|
O3 .2793 .1613 .0377 1.18 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 400 C |
|
_database_code_amcsd 0006681 |
|
4.83184 10.5276 6.1653 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .744 1.18 |
|
MnM1 0 0 0 .256 1.18 |
|
MnM2 .983 .2768 .25 .744 1.18 |
|
MgM2 .983 .2768 .25 .256 1.18 |
|
Si .4244 .0935 .25 .85 |
|
O1 .7591 .0893 .25 1.34 |
|
O2 .2257 .4510 .25 1.21 |
|
O3 .2798 .1611 .0381 1.34 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 450 C |
|
_database_code_amcsd 0006682 |
|
4.83275 10.5385 6.1689 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .762 1.21 |
|
MnM1 0 0 0 .238 1.21 |
|
MnM2 .984 .2770 .25 .762 1.21 |
|
MgM2 .984 .2770 .25 .238 1.21 |
|
Si .4225 .0929 .25 .88 |
|
O1 .7588 .0890 .25 1.39 |
|
O2 .2262 .4511 .25 1.26 |
|
O3 .2797 .1611 .0380 1.43 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 500 C |
|
_database_code_amcsd 0006683 |
|
4.83551 10.5439 6.1727 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .754 1.35 |
|
MnM1 0 0 0 .246 1.35 |
|
MnM2 .982 .2776 .25 .754 1.35 |
|
MgM2 .982 .2776 .25 .246 1.35 |
|
Si .4228 .0931 .25 .89 |
|
O1 .7593 .08921 .25 1.48 |
|
O2 .2258 .4513 .25 1.36 |
|
O3 .2802 .1611 .0382 1.53 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 550 C |
|
_database_code_amcsd 0006684 |
|
4.83884 10.5478 6.17606 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .734 1.26 |
|
MnM1 0 0 0 .266 1.26 |
|
MnM2 .986 .2752 .25 .734 1.26 |
|
MgM2 .986 .2752 .25 .266 1.26 |
|
Si .4227 .0927 .25 .96 |
|
O1 .7587 .0896 .25 1.55 |
|
O2 .2250 .4515 .25 1.45 |
|
O3 .2803 .1610 .0380 1.66 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 600 C |
|
_database_code_amcsd 0006685 |
|
4.8423 10.5515 6.1795 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .723 1.4 |
|
MnM1 0 0 0 .277 1.4 |
|
MnM2 .981 .2781 .25 .723 1.4 |
|
MgM2 .981 .2781 .25 .277 1.4 |
|
Si .4226 .0931 .25 1.01 |
|
O1 .7593 .0898 .25 1.74 |
|
O2 .2253 .4518 .25 1.52 |
|
O3 .2807 .1617 .0384 1.71 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 650 C |
|
_database_code_amcsd 0006686 |
|
4.8459 10.5566 6.1830 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .715 1.8 |
|
MnM1 0 0 0 .285 1.8 |
|
MnM2 .975 .2725 .25 .715 1.8 |
|
MgM2 .975 .2725 .25 .285 1.8 |
|
Si .4238 .0933 .25 1.16 |
|
O1 .7600 .0898 .25 1.82 |
|
O2 .2235 .4513 .25 1.75 |
|
O3 .2824 .1626 .0389 1.85 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 700 C |
|
_database_code_amcsd 0006687 |
|
4.8495 10.5610 6.1873 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .686 1.5 |
|
MnM1 0 0 0 .314 1.5 |
|
MnM2 .989 .2701 .25 .686 1.5 |
|
MgM2 .989 .2701 .25 .314 1.5 |
|
Si .4245 .0936 .25 1.26 |
|
O1 .7606 .0904 .25 1.95 |
|
O2 .2226 .4515 .25 1.90 |
|
O3 .2820 .1620 .0386 1.99 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 750 C |
|
_database_code_amcsd 0006688 |
|
4.8530 10.5664 6.1908 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .691 2.1 |
|
MnM1 0 0 0 .309 2.1 |
|
MnM2 .975 .2710 .25 .691 2.1 |
|
MgM2 .975 .2710 .25 .309 2.1 |
|
Si .4253 .0933 .25 1.31 |
|
O1 .7595 .0904 .25 2.11 |
|
O2 .2224 .4521 .25 1.96 |
|
O3 .2822 .1625 .0385 2.12 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 800 C |
|
_database_code_amcsd 0006689 |
|
4.8657 10.5893 6.2066 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .681 3.0 |
|
MnM1 0 0 0 .319 3.0 |
|
MnM2 .987 .2572 .25 .681 3.0 |
|
MgM2 .987 .2572 .25 .319 3.0 |
|
Si .4235 .0935 .25 1.60 |
|
O1 .7593 .0914 .25 2.45 |
|
O2 .2211 .4519 .25 2.41 |
|
O3 .2840 .1629 .0393 2.63 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 850 C |
|
_database_code_amcsd 0006690 |
|
4.8592 10.5772 6.1988 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .665 2.0 |
|
MnM1 0 0 0 .335 2.0 |
|
MnM2 .985 .2682 .25 .665 2.0 |
|
MgM2 .985 .2682 .25 .335 2.0 |
|
Si .4240 .0941 .25 1.49 |
|
O1 .7593 .0910 .25 2.10 |
|
O2 .2226 .4514 .25 2.15 |
|
O3 .2841 .1625 .0383 2.24 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 900 C |
|
_database_code_amcsd 0006691 |
|
4.8628 10.5827 6.2022 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .671 2.8 |
|
MnM1 0 0 0 .329 2.8 |
|
MnM2 .001 .2626 .25 .671 2.8 |
|
MgM2 .001 .2626 .25 .329 2.8 |
|
Si .4238 .0935 .25 1.58 |
|
O1 .7597 .0904 .25 2.20 |
|
O2 .2204 .4521 .25 2.11 |
|
O3 .2832 .1626 .0393 2.46 |
|
|
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|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 950 C |
|
_database_code_amcsd 0006692 |
|
4.8657 10.5894 6.2066 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .657 3.0 |
|
MnM1 0 0 0 .343 3.0 |
|
MnM2 .998 .2572 .25 .657 3.0 |
|
MgM2 .998 .2572 .25 .343 3.0 |
|
Si .4235 .0935 .25 1.60 |
|
O1 .7593 .0914 .25 2.45 |
|
O2 .2211 .4519 .25 2.42 |
|
O3 .2840 .1629 .0393 2.63 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
MgMnSiO4 |
| |
Redfern S A T, Henderson C M B, Knight K S, Wood B J |
| |
European Journal of Mineralogy 9 (1997) 287-300 |
|
High-temperature order-disorder in (Fe0.5Mn0.5)2SiO4 and (Mg0.5Mn0.5)2SiO4 |
|
olivines: an in situ neutron diffraction study |
|
Sample: T = 1000 C |
|
_database_code_amcsd 0006693 |
|
4.8691 10.5954 6.2114 90 90 90 Pbnm |
|
atom x y z occ Biso |
|
MgM1 0 0 0 .647 2.9 |
|
MnM1 0 0 0 .353 2.9 |
|
MnM2 .986 .2619 .25 .647 2.9 |
|
MgM2 .986 .2619 .25 .353 2.9 |
|
Si .4235 .0927 .25 1.86 |
|
O1 .7598 .0911 .25 2.47 |
|
O2 .2217 .4525 .25 2.50 |
|
O3 .2853 .1628 .0401 2.82 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 5 K |
|
_database_code_amcsd 0007199 |
|
7.39675 7.39675 15.8465 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0253 |
|
Sr .25 .75 0 .5 .0253 |
|
Cu .25 .25 .09138 .0459 |
|
Si .5123 .9335 .15175 .0257 |
|
O1 .4544 .9842 .2459 .0558 |
|
O2 .7178 -.0002 .13313 .0555 |
|
O3 .3736 .0234 .08813 .0668 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 25 K |
|
_database_code_amcsd 0007200 |
|
7.39640 7.39640 15.8466 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0251 |
|
Sr .25 .75 0 .5 .0251 |
|
Cu .25 .25 .09136 .0469 |
|
Si .5122 .9334 .15173 .0254 |
|
O1 .4545 .9840 .2459 .0554 |
|
O2 .7177 -.0002 .13312 .0541 |
|
O3 .3736 .0234 .08812 .0664 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 50 K |
|
_database_code_amcsd 0007201 |
|
7.39601 7.39601 15.8469 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0281 |
|
Sr .25 .75 0 .5 .0281 |
|
Cu .25 .25 .09149 .0498 |
|
Si .5123 .9335 .15179 .0263 |
|
O1 .4543 .9842 .2459 .0606 |
|
O2 .7178 -.0001 .13316 .0574 |
|
O3 .3737 .0234 .08818 .0676 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 100 K |
|
_database_code_amcsd 0007202 |
|
7.39533 7.39533 15.8482 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0378 |
|
Sr .25 .75 0 .5 .0378 |
|
Cu .25 .25 .09160 .0570 |
|
Si .5123 .9336 .15183 .0286 |
|
O1 .4539 .9849 .2459 .0661 |
|
O2 .7179 .0000 .13326 .0641 |
|
O3 .3738 .0236 .08818 .0720 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 150 K |
|
_database_code_amcsd 0007203 |
|
7.39482 7.39482 15.8504 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0483 |
|
Sr .25 .75 0 .5 .0483 |
|
Cu .25 .25 .0918 .0652 |
|
Si .5123 .9335 .15191 .0316 |
|
O1 .4538 .9854 .2459 .0816 |
|
O2 .7180 .0000 .13343 .0708 |
|
O3 .3741 .0239 .08825 .0786 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 200 K |
|
_database_code_amcsd 0007204 |
|
7.39447 7.39447 15.8534 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0576 |
|
Sr .25 .75 0 .5 .0576 |
|
Cu .25 .25 .0919 .0758 |
|
Si .5125 .9337 .15204 .0344 |
|
O1 .4532 .9863 .2459 .0970 |
|
O2 .7183 -.0002 .13358 .0796 |
|
O3 .3744 .0242 .08828 .0854 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 250 K |
|
_database_code_amcsd 0007205 |
|
7.39428 7.39428 15.8573 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0704 |
|
Sr .25 .75 0 .5 .0704 |
|
Cu .25 .25 .0921 .0838 |
|
Si .5126 .9338 .15210 .0389 |
|
O1 .4527 .9870 .2458 .1116 |
|
O2 .7186 -.0002 .13377 .0893 |
|
O3 .3747 .0245 .08834 .0930 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Effenbergerite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 300 K |
|
_database_code_amcsd 0007206 |
|
7.39425 7.39425 15.8621 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0819 |
|
Sr .25 .75 0 .5 .0704 |
|
Cu .25 .25 .0923 .0945 |
|
Si .5130 .9338 .15226 .0433 |
|
O1 .4519 .9877 .2457 .1232 |
|
O2 .7188 -.0002 .13392 .1010 |
|
O3 .3750 .0247 .08834 .1041 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wesselsite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 5 K |
|
_database_code_amcsd 0007207 |
|
7.39675 7.39675 15.8465 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0253 |
|
Sr .25 .75 0 .5 .0253 |
|
Cu .25 .25 .09138 .0459 |
|
Si .5123 .9335 .15175 .0257 |
|
O1 .4544 .9842 .2459 .0558 |
|
O2 .7178 -.0002 .13313 .0555 |
|
O3 .3736 .0234 .08813 .0668 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wesselsite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 25 K |
|
_database_code_amcsd 0007208 |
|
7.39640 7.39640 15.8466 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0251 |
|
Sr .25 .75 0 .5 .0251 |
|
Cu .25 .25 .09136 .0469 |
|
Si .5122 .9334 .15173 .0254 |
|
O1 .4545 .9840 .2459 .0554 |
|
O2 .7177 -.0002 .13312 .0541 |
|
O3 .3736 .0234 .08812 .0664 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wesselsite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 50 K |
|
_database_code_amcsd 0007209 |
|
7.39601 7.39601 15.8469 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0281 |
|
Sr .25 .75 0 .5 .0281 |
|
Cu .25 .25 .09149 .0498 |
|
Si .5123 .9335 .15179 .0263 |
|
O1 .4543 .9842 .2459 .0606 |
|
O2 .7178 -.0001 .13316 .0574 |
|
O3 .3737 .0234 .08818 .0676 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wesselsite |
| |
Knight K S, Henderson C M B |
| |
European Journal of Mineralogy 19 (2007) 189-200 |
|
Structural basis for the anomalous low-temperature thermal expansion |
|
behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 |
|
Sample: T = 100 K |
|
_database_code_amcsd 0007210 |
|
7.39533 7.39533 15.8482 90 90 90 *P4/ncc |
|
.25 -.25 0 |
|
atom x y z occ Uiso |
|
Ba .25 .75 0 .5 .0378 |
|
Sr .25 .75 0 .5 .0378 |
|
Cu .25 .25 .09160 .0570 |
|
Si .5123 .9336 .15183 .0286 |
|
O1 .4539 .9849 .2459 .0661 |
|
O2 .7179 .0000 .13326 .0641 |
|
O3 .3738 .0236 .08818 .0720 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
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