|
Jadeite |
 |
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
 |
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd100Ae0 |
|
_database_code_amcsd 0004445 |
|
9.4278 8.5651 5.2262 90 107.624 90 C2/c |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
NaM2 0 .3002 .25 .0108 .0146 .0075 .0090 0 -.0006 0 |
|
AlM1 0 .90604 .25 .0043 .0048 .0044 .0042 0 .0012 0 |
|
SiT .29072 .09342 .22822 .00383 .0039 .0040 .0041 -.0003 .0010 -.0004 |
|
O1 .1092 .0760 .1284 .0049 .0043 .0053 .0054 -.0004 .0009 -.0003 |
|
O2 .3610 .2634 .2935 .0070 .0076 .0052 .0084 -.0020 .0022 -.0004 |
|
O3 .3536 .0071 .0067 .0065 .0059 .0083 .0059 .0006 .0013 -.0025 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
|
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd74Ae26 |
|
_database_code_amcsd 0004446 |
|
9.4781 8.6180 5.2449 90 107.570 90 C2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
NaM2 0 .30029 .25 .0114 .0143 .0076 .0094 0 -.0008 0 |
|
AlM1 0 .90369 .25 .74 .00494 .0050 .0047 .0050 0 .0012 0 |
|
Fe3+M1 0 .90369 .25 .26 .00494 .0050 .0047 .0050 0 .0012 0 |
|
SiT .29055 .09232 .22978 .00443 .0042 .0046 .0045 -.00024 .00125 -.00023 |
|
O1 .11032 .07663 .1303 .0063 .0046 .0069 .0070 .0001 .0014 -.0001 |
|
O2 .36029 .26139 .2952 .0078 .0094 .0052 .0085 -.0019 .0027 -.0007 |
|
O3 .35324 .00755 .0075 .0068 .0062 .0085 .0057 .0001 .0019 -.0021 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Aegirine |
|
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
|
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd35Ae65 |
|
_database_code_amcsd 0004447 |
|
9.5663 8.7040 5.2733 90 107.600 90 C2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
NaM2 0 .29844 .25 .0118 .0140 .0095 .0086 0 -.0014 0 |
|
AlM1 0 .90134 .25 .35 .00542 .0053 .0053 .0054 0 .00117 0 |
|
Fe3+M1 0 .90134 .25 .65 .00542 .0053 .0053 .0054 0 .00117 0 |
|
SiT .29075 .09083 .23362 .00500 .0046 .0053 .0051 -.00007 .00150 -.00021 |
|
O1 .11233 .07785 .1345 .0078 .0052 .0086 .0094 .0006 .0018 -.0002 |
|
O2 .35929 .25862 .2992 .0096 .0118 .0061 .0109 -.0020 .0033 -.0010 |
|
O3 .35289 .00802 .0111 .0078 .0065 .0104 .0064 .0008 .0018 -.0021 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Aegirine |
|
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
|
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd0Ae100 |
|
_database_code_amcsd 0004448 |
|
9.6623 8.8000 5.2956 90 107.579 90 C2/c |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
NaM2 0 .2961 .25 .0116 .0132 .0125 .0062 0 -.0031 .0000 |
|
Fe3+M1 0 .89921 .25 .0049 .0052 .0046 .0051 0 .00039 0 |
|
SiT .29115 .08942 .23765 .0049 .0046 .0047 .0054 -.0006 .0006 -.00022 |
|
O1 .1146 .0789 .1393 .0067 .0052 .0080 .0070 -.0001 .0006 .0011 |
|
O2 .3591 .2556 .3032 .0097 .0107 .0063 .0125 -.0033 .0033 -.0014 |
|
O3 .3526 .0080 .0146 .0079 .0068 .0107 .0063 .000 .0009 -.0029 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
|
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd53Hd47 |
|
_database_code_amcsd 0004449 |
|
9.6031 8.7735 5.2656 90 106.725 90 C2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
NaM2 0 .30094 .25 .53 .0124 .0165 .0093 .0090 0 -.0001 0 |
|
CaM2 0 .30094 .25 .47 .0124 .0165 .0093 .0090 0 -.0001 0 |
|
FeM2' 0 .257 .25 .03 .007 |
|
AlM1 0 .90504 .25 .52 .0074 .0075 .0080 .0065 0 .0019 0 |
|
Fe2+M1 0 .90504 .25 .48 .0074 .0075 .0080 .0065 0 .0019 0 |
|
SiT .28845 .09209 .22982 .0066 .0068 .0077 .0056 .0003 .0025 -.0011 |
|
O1 .1126 .0808 .1366 .0143 .0069 .0191 .0168 .0024 .0030 -.0046 |
|
O2 .3600 .2554 .3079 .0131 .0190 .0095 .0102 -.0004 .0032 -.0012 |
|
O3 .3518 .0133 .0013 .0098 .0090 .0128 .0080 .0010 .0033 -.0022 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hedenbergite |
|
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
|
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd24Hde76 |
|
_database_code_amcsd 0004450 |
|
9.7340 8.9103 5.2682 90 105.904 90 C2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
NaM2 0 .30061 .25 .24 .0114 .0137 .0090 .0092 0 -.0005 0 |
|
CaM2 0 .30061 .25 .76 .0114 .0137 .0090 .0092 0 -.0005 0 |
|
AlM1 0 .90603 .25 .24 .0075 .0074 .0073 .0071 0 .0009 0 |
|
Fe2+M1 0 .90603 .25 .76 .0075 .0074 .0073 .0071 0 .0009 0 |
|
SiT .28782 .09199 .2317 .0069 .0064 .0082 .0060 .0002 .0017 -.0006 |
|
O1 .1165 .0853 .1451 .0142 .0095 .0203 .0129 .0016 .0031 -.0028 |
|
O2 .3609 .2510 .3166 .0136 .0201 .0091 .0112 -.0007 .0035 -.0006 |
|
O3 .3510 .0160 -.0016 .0099 .0094 .0128 .0076 .0002 .0026 -.0027 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hedenbergite |
|
Nestola F, Tribaudino M, Ballaran T B, Liebske C, Bruno M |
|
American Mineralogist 92 (2007) 1492-1501 |
|
The crystal structures of pyroxenes along the jadeite - hedenbergite and |
|
jadeite - aegirine joins |
|
Locality: synthetic |
|
Sample: Jd0Hd100 |
|
_database_code_amcsd 0004451 |
|
9.8447 9.0234 5.2509 90 104.862 90 C2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
CaM2 0 .30034 .25 .99 .00873 .0104 .0073 .0073 0 .0001 0 |
|
FeM2' 0 .242 .25 .01 .0065 |
|
Fe2+M1 0 .90741 .25 .00635 .0067 .0058 .0063 0 .0011 0 |
|
SiT .28786 .09244 .23259 .0050 .0050 .0052 .0048 -.0002 .0012 -.0004 |
|
O1 .1194 .0901 .1519 .0074 .0056 .0093 .0072 .0001 .0016 .0000 |
|
O2 .3630 .2465 .3237 .0097 .0122 .0068 .0096 .0029 .0019 -.0010 |
|
O3 .3502 .0198 -.0066 .0079 .0067 .0100 .0070 -.0001 .0017 -.0024 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd0Hd100 at P = 0 GPa |
|
_database_code_amcsd 0004600 |
|
9.8447 9.0234 5.2509 90 104.862 90 C2/c |
|
atom x y z Uiso |
|
CaM2 0 .3001 .25 .0083 |
|
Fe2+M1 0 .90740 .25 .0065 |
|
SiT .2877 .09253 .2325 .0052 |
|
O1 .1193 .0907 .1522 .0083 |
|
O2 .3624 .2464 .3245 .0089 |
|
O3 .3502 .0195 .9938 .0090 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd0Hd100 at P = 3.80 GPa |
|
_database_code_amcsd 0004601 |
|
9.7553 8.8998 5.1923 90 104.290 90 C2/c |
|
atom x y z Uiso |
|
CaM2 0 .3021 .25 .0096 |
|
Fe2+M1 0 .9086 .25 .0086 |
|
SiT .2878 .0936 .2314 .0061 |
|
O1 .1201 .0911 .1522 .0092 |
|
O2 .3621 .2496 .3262 .013 |
|
O3 .3519 .0226 .9885 .010 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd100Hd0, P = 0 GPa |
|
_database_code_amcsd 0004602 |
|
9.4278 8.5651 5.2262 90 107.624 90 C2/c |
|
atom x y z Uiso |
|
NaM2 0 .3002 .25 .0086 |
|
AlM1 0 .9061 .25 .0049 |
|
SiT .2902 .0935 .2281 .0045 |
|
O1 .1112 .0757 .1293 .0056 |
|
O2 .3602 .2634 .2939 .0072 |
|
O3 .3534 .0071 1.0066 .0075 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd100Hd0, P = 3.14 GPa |
|
_database_code_amcsd 0004603 |
|
9.3488 8.5013 5.1856 90 107.345 90 C2/c |
|
atom x y z Uiso |
|
NaM2 0 .3019 .25 .0110 |
|
AlM1 0 .9076 .25 .0059 |
|
SiT .2905 .0941 .2288 .0050 |
|
O1 .1090 .0782 .1291 .006 |
|
O2 .3603 .2652 .2976 .007 |
|
O3 .3555 .0099 1.0052 .008 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd100Hd0, P = 8.31 GPa |
|
_database_code_amcsd 0004604 |
|
9.2411 8.4053 5.1236 90 106.906 90 C2/c |
|
atom x y z Uiso |
|
NaM2 0 .3041 .25 .0091 |
|
AlM1 0 .9082 .25 .0053 |
|
SiT .2908 .0949 .2294 .0055 |
|
O1 .1093 .0784 .1309 .0046 |
|
O2 .3596 .2674 .3027 .008 |
|
O3 .3566 .0146 1.0009 .007 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd24Hd76, P = 0 GPa |
|
_database_code_amcsd 0004605 |
|
9.7340 8.9103 5.2682 90 105.904 90 C2/c |
|
atom x y z occ Uiso |
|
NaM2 0 .3006 .25 .24 .0094 |
|
CaM2 0 .3006 .25 .76 .0094 |
|
AlM1 0 .9059 .25 .24 .0077 |
|
Fe2+M1 0 .9059 .25 .76 .0077 |
|
SiT .2883 .0920 .2315 .0077 |
|
O1 .1146 .0855 .1454 .0163 |
|
O2 .3610 .2508 .3167 .0107 |
|
O3 .3496 .0158 .9987 .0108 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hedenbergite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd24Hd76, P = 3.87 GPa |
|
_database_code_amcsd 0004606 |
|
9.6410 8.7920 5.2122 90 105.391 90 C2/c |
|
atom x y z occ Uiso |
|
NaM2 0 .3019 .25 .24 .012 |
|
CaM2 0 .3019 .25 .76 .012 |
|
AlM1 0 .9056 .25 .24.0061 |
|
Fe2+M1 0 .9056 .25 .76.0061 |
|
SiT .2885 .0927 .2317 .010 |
|
O1 .1167 .086 .1482 .014 |
|
O2 .3602 .2539 .320 .019 |
|
O3 .3540 .0200 .9946 .008 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hedenbergite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd24Hd76, P = 8.76 GPa |
|
_database_code_amcsd 0004607 |
|
9.5525 8.6648 5.1550 90 104.972 90 C2/c |
|
atom x y z occ Uiso |
|
NaM2 0 .305 .25 .24 .012 |
|
CaM2 0 .305 .25 .76 .012 |
|
AlM1 0 .908 .25 .24 .007 |
|
Fe2+M1 0 .908 .25 .76 .007 |
|
SiT .2883 .0946 .2309 .012 |
|
O1 .1155 .089 .146 .014 |
|
O2 .359 .2583 .323 .021 |
|
O3 .3550 .023 .989 .011 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd53Hd47, P = 0 GPa |
|
_database_code_amcsd 0004608 |
|
9.6031 8.7735 5.2656 90 106.725 90 C2/c |
|
atom x y z occ Uiso |
|
NaM2 0 .3008 .25 .53 .0133 |
|
CaM2 0 .3008 .25 .47 .0133 |
|
AlM1 0 .9050 .25 .52 .0079 |
|
Fe2+M1 0 .9050 .25 .48 .0079 |
|
SiT .2883 .0922 .2298 .0078 |
|
O1 .1122 .0802 .1365 .0189 |
|
O2 .3593 .2556 .3088 .0112 |
|
O3 .3525 .0128 1.0011 .0113 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd53Hd47, P = 3.65 GPa |
|
_database_code_amcsd 0004609 |
|
9.5135 8.6765 5.2158 90 106.317 90 C2/c |
|
atom x y z occ Uiso |
|
NaM2 0 .3024 .25 .53 .011 |
|
CaM2 0 .3024 .25 .47 .011 |
|
AlM1 0 .9061 .25 .52 .0087 |
|
Fe2+M1 0 .9061 .25 .48 .0087 |
|
SiT .2886 .0920 .2301 .0068 |
|
O1 .1145 .0817 .1369 .015 |
|
O2 .3591 .2571 .3093 .013 |
|
O3 .3529 .0166 .9982 .009 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Jadeite |
|
Nestola F, Ballaran T B, Liebske C, Thompson R, Downs R T |
| |
American Mineralogist 93 (2008) 1005-1013 |
|
The effect of the hedenbergitic substitution on the compressibility |
|
of jadeite |
|
Locality: Synthetic |
|
Sample: Jd53Hd47, P = 6.09 GPa |
|
_database_code_amcsd 0004610 |
|
9.4632 8.6170 5.1857 90 106.097 90 C2/c |
|
atom x y z occ Uiso |
|
NaM2 0 .3046 .25 .53 .012 |
|
CaM2 0 .3046 .25 .47 .012 |
|
AlM1 0 .9066 .25 .52 .0068 |
|
Fe2+M1 0 .9066 .25 .48 .0068 |
|
SiT .2888 .0928 .2300 .0074 |
|
O1 .1125 .0825 .1366 .014 |
|
O2 .3588 .2589 .3124 .012 |
|
O3 .3544 .0188 .9967 .011 |
|
|
| 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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