|
Chkalovite |
 |
Pyatenko Y A, Bokii G B, Belov N V |
| |
Doklady Akademii Nauk SSSR 108 (1956) 1077-1080 |
|
The X-ray analysis of the crystal structure of chkalovite |
|
_database_code_amcsd 0012436 |
|
21.1 21.1 6.87 90 90 90 Fddd |
|
atom x y z |
|
Be1 0 0 0 |
|
Be2 0 .33 0 |
|
Si1 .346 0 0 |
|
Si2 .071 .093 .25 |
|
Na1 .154 0 0 |
|
Na2 .071 .093 .75 |
|
O1 .125 .125 .125 |
|
O2 .04 .03 .16 |
|
O3 .03 .13 .37 |
|
O4 .13 .06 .37 |
|
O5 .2 .04 .66 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Prosopite |
|
Pudovkina Z V, Pyatenko Y A |
| |
Doklady Akademii Nauk SSSR 190 (1970) 665-667 |
|
About the structure of the prosopite, Ca[Al2F4(OH)4], and about |
|
some features of the fluoroaluminate crystal chemistry |
|
_database_code_amcsd 0012448 |
|
6.76 11.12 7.32 90 95.00 90 C2/c |
|
atom x y z Biso |
|
Ca 0 .461 .25 .62 |
|
AlI .25 .25 0 .62 |
|
AlII 0 .143 .25 .62 |
|
FI .077 .382 .965 .62 |
|
FII .182 .021 .285 .62 |
|
OHI .201 .264 .257 .62 |
|
OHII .023 .15 .997 .62 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Kazakovite |
|
Voronkov A A, Pudovkina Z V, Blinov V A, Ilyukhin V V, Pyatenko Y A |
| |
Doklady Akademii Nauk SSSR 245 (1979) 106-109 |
|
Crystal structure of kazakovite Na6Mn{Ti[Si6O18]} |
|
_database_code_amcsd 0012462 |
|
7.310 7.310 7.310 88.11 88.11 88.11 R-3m |
|
atom x y z occ Biso |
|
Na1 0 0 .5 1.59 |
|
Na2 .5 .5 0 2.08 |
|
Mn .2438 .2438 .2438 .5 1.60 |
|
Ti 0 0 0 .22 |
|
Si .2791 .2791 .7348 .78 |
|
O1 .2133 .2133 .5472 1.98 |
|
O2 .1843 .1843 .9149 1.46 |
|
O3 .2416 .7584 .5 1.83 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Imandrite |
|
Chernitsova N M, Pudovkina Z V, Voronkov A A, Ilyukhin V V, Pyatenko Y A |
| |
Doklady Akademii Nauk SSSR 252 (1980) 618-621 |
|
Imandrite Na12Ca3Fe2[Si6O18]2 - a representative of |
|
a new branch in the lovozerite structural family |
|
_database_code_amcsd 0012468 |
|
10.331 10.546 7.426 90 90 90 Pmnn |
|
atom x y z occ Biso |
|
Na1 0 0 .5 .19 |
|
Na2 .2407 .2334 .0207 1.61 |
|
Na3 .5 0 0 3.97 |
|
Ca .5 .2549 .7563 .75 .96 |
|
Fe 0 0 0 .99 |
|
Si1 .2723 .9920 .7152 .69 |
|
Si2 .5 .2184 .2564 .77 |
|
O1 0 .199 .935 2.04 |
|
O2 .128 .376 .755 2.38 |
|
O3 .5 .290 .073 1.50 |
|
O4 .364 .444 .697 1.68 |
|
O5 .329 .121 .787 1.94 |
|
O6 .240 0 .5 2.89 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Parakeldyshite |
|
Voronkov A A, Shumyatskaya N G, Pyatenko Y A |
| |
Journal of Structural Chemistry 11 (1970) 866-867 |
|
Crystal structure of a new natural modification of Na2Zr[Si2O7] |
|
Locality: synthetic |
|
_database_code_amcsd 0014056 |
|
6.66 8.83 5.42 92.75 94.25 72.33 P-1 |
|
atom x y z |
|
Na1 .874 .099 .264 |
|
Na2 .299 .492 .738 |
|
Zr .289 .271 .220 |
|
Si1 .642 .146 .772 |
|
Si2 .935 .336 .689 |
|
O1 .296 .037 .176 |
|
O2 .884 .169 .745 |
|
O3 .497 .206 .524 |
|
O4 .557 .252 .023 |
|
O5 .002 .316 .395 |
|
O6 .123 .340 .886 |
|
O7 .300 .520 .230 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Prosopite |
|
Pudovkina Z V, Chernitsova N M, Pyatenko Y A |
| |
Journal of Structural Chemistry 14 (1973) 345-347 |
|
Refinement of the crystalline structure of prosopite, CaAl2F4(OH)4 |
|
_database_code_amcsd 0014057 |
|
6.76 11.12 7.32 90 95.0 90 C2/c |
|
atom x y z Biso |
|
Ca 0 .4606 .25 .67 |
|
Al1 .25 .25 0 .57 |
|
Al2 0 .1407 .25 .55 |
|
F1 .0761 .3810 .9625 .88 |
|
F2 .1818 .0244 .2819 .94 |
|
OH1 .1998 .2632 .2439 .59 |
|
OH2 .0231 .1534 .9971 .64 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Vlasovite |
|
Voronkov A A, Zhdanova T A, Pyatenko Y A |
| |
Kristallografiya 19 (1974) 252-259 |
|
Refinement of the structure of vlasovite Na2ZrSi4O11 and some characteristics of |
|
the composition and structure of the zirconosilicates |
|
_database_code_amcsd 0014182 |
|
10.98 10.00 8.52 90 100.40 90 C2/c |
|
atom x y z Biso |
|
Na1 0 .075 .75 3.4 |
|
Na2 0 .395 .75 5.1 |
|
Zr .25 .25 0 1.9 |
|
Si1 .2637 .0722 .6385 1.4 |
|
Si2 .0498 .2178 .4272 1.4 |
|
O1 0 .160 .25 2.2 |
|
O2 .143 .106 .505 2.7 |
|
O3 .115 .358 .419 3.1 |
|
O4 .056 .230 .971 1.9 |
|
O5 .242 .134 .801 2.3 |
|
O6 .287 .084 .145 2.3 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Sazhinite-(Ce) |
|
Shumyatskaya N G, Voronkov A A, Pyatenko Y A |
| |
Soviet Physics - Crystallography 25 (1980) 419-423 |
|
Sazhinite, Na2Ce[Si6O14(OH)]*nH2O: a new representative of the dalyite family in crystal chemistry |
|
_database_code_amcsd 0015583 |
|
7.50 15.62 7.35 90 90 90 Pmm2 |
|
atom x y z Biso |
|
Ce1 0 .26 .004 3.55 |
|
Si1 .284 .094 .76 3.29 |
|
Si2 .298 .402 .295 2.88 |
|
Si3 0 .164 .496 4.39 |
|
Si4 0 .365 .592 3.74 |
|
Na1 .5 .261 .005 3.86 |
|
Na2 .222 .5 .875 6.87 |
|
O1 .257 0 .823 3.69 |
|
O2 .245 .335 .139 5.18 |
|
O3 .241 .171 .916 3.58 |
|
O4 .192 .114 .565 2.56 |
|
O5 .171 .398 .487 5.69 |
|
O6 .254 .5 .232 3.95 |
|
OH7 0 .189 .276 4.56 |
|
O8 0 .259 .604 4.57 |
|
O9 0 .392 .789 6.36 |
|
O10 .5 .113 .688 4.45 |
|
O11 .5 .402 .377 5.18 |
|
Wat12 .5 .373 .766 4.22 |
|
Wat13 0 0 .138 10.02 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Stillwellite-(Ce) |
|
Voronkov A A, Pyatenko Y A |
| |
Soviet Physics Crystallography 12 (1967) 214-220 |
|
X-ray diffraction study of the atomic structure of stillwellite CeBO[SiO4] |
|
Locality: Soviet |
|
_database_code_amcsd 0018733 |
|
6.85 6.85 6.70 90 90 120 P3_1 |
|
atom x y z |
|
Ce .587 0 0 |
|
B .113 0 .973 |
|
Si .585 0 .5 |
|
O1 .339 .194 .023 |
|
O2 .195 .339 .31 |
|
O3 .613 .464 .32 |
|
O4 .464 .614 .014 |
|
O5 .051 .051 .781 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Sidorenkite |
|
Kurova T A, Shumyatskaya N G, Voronkov A A, Pyatenko Y A |
| |
Soviet Physics Doklady 25 (1980) 156-157 |
|
Crystal structure of sidorenkite Na3Mn(PO4)(CO3) |
|
_database_code_amcsd 0015607 |
|
8.997 6.741 5.163 90 90.16 90 P2_1/m |
|
atom x y z Biso |
|
Na1 .7409 .9978 .7513 1.44 |
|
Na2 .0822 .25 .7615 1.88 |
|
Mn .3624 .75 .7799 1.00 |
|
P .4125 .25 .7011 .55 |
|
C .0605 .75 .7345 .76 |
|
O1 .1233 .75 .9616 1.37 |
|
O2 .1430 .75 .5317 1.30 |
|
O3 .9195 .75 .7157 1.48 |
|
O4 .3210 .4345 .7817 1.23 |
|
O5 .5684 .25 .8260 1.05 |
|
O6 .5694 .75 .5965 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
|
| |
|
Tadzhikite-(Ce) |
| |
Chernitsova N M, Pudovkina Z V, Pyatenko Y A |
| |
Soviet Physics Doklady 27 (1982) 367-368 |
|
About the crystal structure of tadzhikite {(Ca,Tr)4(Y,Tr)2(Ti,Fe,Al)(O,OH)2 |
|
[Si4B4O22]} |
|
_database_code_amcsd 0015611 |
|
18.946 4.714 10.302 90 111.58 90 P2/a |
|
atom x y z occ Biso |
|
Ca1 .2518 0 .3399 .99 |
|
Ca2 .3450 .9616 .0708 .99 |
|
Ce .0421 .0194 .3595 1.02 |
|
Ti 0 0 0 .40 1.14 |
|
Fe 0 0 0 .34 1.14 |
|
Al 0 0 0 .26 1.14 |
|
B1 .171 .523 .448 .32 |
|
B2 .244 .460 .861 1.12 |
|
Si1 .1015 .488 .647 .84 |
|
Si2 .3871 .496 .837 .84 |
|
O1 .460 .244 .439 1.10 |
|
O2 .323 .319 .243 .90 |
|
O3 .070 .706 .730 1.30 |
|
O4 .131 .667 .538 1.00 |
|
O5 .462 .192 .132 1.00 |
|
O6 .255 .759 .140 1.20 |
|
O7 .166 .229 .447 .50 |
|
O8 .132 .676 .310 1.00 |
|
O9 .312 .330 .838 1.40 |
|
O10 .086 .733 .042 1.00 |
|
O11 .055 .255 .159 1.60 |
|
O12 .25 .331 0 .30 |
|
O13 .25 .652 .5 .70 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Lithosite |
|
Pudovkina Z V, Solov'eva L P, Pyatenko Y A |
| |
Soviet Physics Doklady 31 (1986) 941-942 |
|
Crystal structure of lithosite K3[HAl2Si4O13] |
|
_database_code_amcsd 0015615 |
|
15.197 10.233 8.435 90 90.31 90 P2_1 |
|
atom x y z Biso |
|
K1 .697 .054 .752 1.42 |
|
K2 .422 .046 .752 1.84 |
|
K3 .136 .064 .738 2.13 |
|
K4 .801 .947 .247 1.43 |
|
K5 .078 .938 .248 1.90 |
|
K6 .370 .944 .244 1.90 |
|
Al1 .910 .110 .930 .64 |
|
Al2 .563 .188 .443 .83 |
|
Al3 .936 .809 .558 .70 |
|
Al4 .590 .891 .064 .65 |
|
Si1 .262 .219 .435 .62 |
|
Si2 .259 .221 .063 .37 |
|
Si3 .561 .192 .053 .87 |
|
Si4 .914 .111 .559 .81 |
|
Si5 .243 .778 .939 .98 |
|
Si6 .237 .777 .565 .68 |
|
Si7 .586 .886 .439 .78 |
|
Si8 .940 .807 .942 .86 |
|
O1 .248 .188 .249 1.40 |
|
O2 .995 .219 .948 1.09 |
|
O3 .005 .721 .436 1.56 |
|
O4 .293 .101 .958 1.21 |
|
O5 .548 .027 .501 1.38 |
|
O6 .552 .039 .997 1.18 |
|
O7 .706 .597 .468 1.03 |
|
O8 .547 .218 .245 1.39 |
|
O9 .824 .153 .453 1.31 |
|
O10 .824 .153 .054 1.46 |
|
O11 .123 .598 .257 1.49 |
|
O12 .167 .272 .501 1.37 |
|
O13 .156 .245 .001 1.43 |
|
O14 .247 .821 .754 1.06 |
|
O15 .507 .781 .451 .87 |
|
O16 .511 .773 .051 1.73 |
|
O17 .196 .908 .479 1.24 |
|
O18 .947 .961 .000 1.28 |
|
O19 .946 .970 .486 .98 |
|
O20 .204 .904 .024 1.06 |
|
O21 .048 .295 .240 1.61 |
|
O22 .690 .854 .970 .60 |
|
O23 .665 .844 .560 1.21 |
|
O24 .624 .898 .263 1.14 |
|
O25 .663 .234 .001 1.43 |
|
O26 .331 .745 .494 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
|
| |
Multiple datasets can be concatenated into a single downloadable file by
selecting the datasets and then hitting the "Download Selected Data" button.
