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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=1203",
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"results": [
{
"id": "jvasp-17266",
"created_at": "2022-09-04T14:37:45.597193Z",
"updated_at": "2022-09-04T14:37:45.597222Z",
"structure_string": "Sc2 Si2 Pt4\n1.0\n3.702689 0.000000 0.000000\n-1.851345 4.989816 -0.000000\n0.000000 0.000000 7.016519\nSc Si Pt\n2 2 4\ndirect\n0.952837 0.905672 0.250000 Sc\n0.047165 0.094329 0.750000 Sc\n0.233705 0.467408 0.250000 Si\n0.766297 0.532593 0.750000 Si\n0.363327 0.726653 0.547439 Pt\n0.636675 0.273348 0.452562 Pt\n0.636675 0.273348 0.047438 Pt\n0.363327 0.726653 0.952562 Pt\n",
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{
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"structure_string": "Ga2\n1.0\n2.633518 0.000000 -0.938924\n0.000000 3.423523 -0.000000\n0.040638 -0.000000 4.276726\nGa\n2\ndirect\n0.866754 0.250000 0.733508 Ga\n0.133248 0.749999 0.266494 Ga\n",
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{
"id": "jvasp-56811",
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"structure_string": "Ba6 W2 Cl4 O10\n1.0\n5.839850 -0.000000 -0.000000\n-2.919924 6.913101 0.000000\n-0.000000 0.000000 11.603689\nBa W Cl O\n6 2 4 10\ndirect\n0.650352 0.300704 0.956755 Ba\n0.349649 0.699296 0.456755 Ba\n0.650352 0.300704 0.543245 Ba\n0.907661 0.815320 0.750000 Ba\n0.349649 0.699296 0.043245 Ba\n0.092340 0.184680 0.250000 Ba\n0.756888 0.513776 0.250000 W\n0.243113 0.486224 0.750000 W\n0.506256 0.012512 0.250000 Cl\n0.000000 0.000000 0.500000 Cl\n0.493745 0.987488 0.750000 Cl\n0.000000 0.000000 0.000000 Cl\n0.944968 0.441630 0.363387 O\n0.944968 0.441630 0.136613 O\n0.115110 0.230219 0.750000 O\n0.503338 0.558370 0.636613 O\n0.055032 0.558370 0.863387 O\n0.884891 0.769781 0.250000 O\n0.055032 0.558370 0.636613 O\n0.503338 0.558370 0.863387 O\n0.496663 0.441630 0.136613 O\n0.496663 0.441630 0.363387 O\n",
"nsites": 22,
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"elements": [
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"formula_full": "Ba6 W2 Cl4 O10",
"formula_reduced": "Ba3WCl2O5",
"formula_anonymous": "AB2C3D5",
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"spacegroup": 63
},
{
"id": "jvasp-109013",
"created_at": "2022-09-04T14:37:46.912221Z",
"updated_at": "2022-09-04T14:37:46.912240Z",
"structure_string": "Mo2 O6\n1.0\n7.386014 0.039823 0.000000\n-6.443238 3.611022 0.000000\n-0.000000 -0.000000 3.754486\nMo O\n2 6\ndirect\n0.104793 0.895206 0.250000 Mo\n0.895205 0.104793 0.750001 Mo\n0.931036 0.068962 0.250000 O\n0.068962 0.931036 0.750001 O\n0.584317 0.415681 0.250000 O\n0.415681 0.584318 0.750001 O\n0.221830 0.778169 0.250000 O\n0.778168 0.221830 0.750001 O\n",
"nsites": 8,
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"elements": [
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"density": 4.728313327622967,
"density_atomic": 0.07912998335721777,
"volume": 101.09947785386824,
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"formula_full": "Mo2 O6",
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"spacegroup": 63
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{
"id": "jvasp-56853",
"created_at": "2022-09-04T14:37:47.397147Z",
"updated_at": "2022-09-04T14:37:47.397178Z",
"structure_string": "Mg2 Zn4\n1.0\n4.615991 0.249045 0.000000\n-2.092316 4.122087 0.000000\n-0.000000 0.000000 5.383595\nMg Zn\n2 4\ndirect\n0.641097 0.358904 0.250000 Mg\n0.358902 0.641098 0.749999 Mg\n0.706333 0.293668 0.749999 Zn\n0.000000 0.000000 0.000000 Zn\n0.293667 0.706334 0.250000 Zn\n0.000000 0.000000 0.500000 Zn\n",
"nsites": 6,
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"elements": [
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"formula_full": "Mg2 Zn4",
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"spacegroup": 63
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{
"id": "jvasp-25620",
"created_at": "2022-09-04T14:37:47.591610Z",
"updated_at": "2022-09-04T14:37:47.591639Z",
"structure_string": "Na12 Pb2 O10\n1.0\n5.728944 -0.000000 0.000000\n-2.864472 5.361422 -0.000000\n0.000000 -0.000000 11.004671\nNa Pb O\n12 2 10\ndirect\n0.322522 0.000000 0.059919 Na\n0.781512 0.563027 0.500000 Na\n0.218487 0.436973 0.000000 Na\n0.167389 0.596099 0.250000 Na\n0.677477 0.000000 0.940082 Na\n0.218487 0.436973 0.500000 Na\n0.571289 0.403901 0.250000 Na\n0.781512 0.563027 0.000000 Na\n0.428710 0.596099 0.750000 Na\n0.677477 0.000000 0.559918 Na\n0.322522 0.000000 0.440082 Na\n0.832610 0.403901 0.750000 Na\n0.205995 0.000000 0.750000 Pb\n0.794005 0.000000 0.250000 Pb\n0.834791 0.280484 0.113261 O\n0.165208 0.719515 0.886739 O\n0.554306 0.719515 0.113261 O\n0.554306 0.719515 0.386739 O\n0.445693 0.280484 0.886739 O\n0.165208 0.719515 0.613261 O\n0.169878 0.000000 0.250000 O\n0.830121 0.000000 0.750000 O\n0.445693 0.280484 0.613261 O\n0.834791 0.280484 0.386739 O\n",
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"formula_full": "Na12 Pb2 O10",
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"formula_anonymous": "AB5C6",
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"spacegroup": 63
},
{
"id": "jvasp-58434",
"created_at": "2022-09-04T14:37:50.802067Z",
"updated_at": "2022-09-04T14:37:50.802084Z",
"structure_string": "Al4 Si2 O10\n1.0\n3.554431 0.000000 0.000000\n-1.777216 4.641022 0.000000\n0.000000 -0.000000 9.181571\nAl Si O\n4 2 10\ndirect\n0.135061 0.270121 0.432554 Al\n0.864938 0.729879 0.567446 Al\n0.135061 0.270121 0.067446 Al\n0.864938 0.729879 0.932554 Al\n0.183773 0.367547 0.750000 Si\n0.816225 0.632452 0.250000 Si\n0.312687 0.625375 0.589453 O\n0.687312 0.374624 0.410547 O\n0.687312 0.374624 0.089453 O\n0.312687 0.625375 0.910547 O\n0.054916 0.109834 0.617881 O\n0.945082 0.890166 0.382119 O\n0.739613 0.479228 0.750000 O\n0.260385 0.520772 0.250000 O\n0.054916 0.109834 0.882119 O\n0.945082 0.890166 0.117881 O\n",
"nsites": 16,
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"volume": 151.46096237903274,
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"formula_full": "Al4 Si2 O10",
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"spacegroup": 63
},
{
"id": "jvasp-19736",
"created_at": "2022-09-04T14:37:48.619977Z",
"updated_at": "2022-09-04T14:37:48.620003Z",
"structure_string": "Zr2 Si4\n1.0\n3.696401 0.000000 0.000000\n-0.000000 3.609009 -0.918927\n-0.000000 0.041597 7.709880\nZr Si\n2 4\ndirect\n0.750000 0.105975 0.211950 Zr\n0.250000 0.894026 0.788050 Zr\n0.250000 0.552782 0.105563 Si\n0.750000 0.447219 0.894436 Si\n0.750000 0.749665 0.499330 Si\n0.250000 0.250336 0.500670 Si\n",
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"volume": 102.99374854671,
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},
{
"id": "jvasp-16289",
"created_at": "2022-09-04T14:37:49.272995Z",
"updated_at": "2022-09-04T14:37:49.273017Z",
"structure_string": "Yb2 Si2\n1.0\n3.876540 -0.000000 0.000000\n-0.000000 4.180965 -1.694284\n0.000000 -0.097541 5.765101\nYb Si\n2 2\ndirect\n0.250000 0.860946 0.721891 Yb\n0.750000 0.139055 0.278110 Yb\n0.250000 0.570914 0.141828 Si\n0.750000 0.429087 0.858173 Si\n",
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},
{
"id": "jvasp-21027",
"created_at": "2022-09-04T14:37:48.918760Z",
"updated_at": "2022-09-04T14:37:48.918781Z",
"structure_string": "Sc6 Fe4 Si6\n1.0\n3.948797 0.000000 -0.000000\n-1.974399 4.958320 -0.000000\n0.000000 0.000000 12.912271\nSc Fe Si\n6 4 6\ndirect\n0.360771 0.721541 0.750000 Sc\n0.080487 0.160975 0.612724 Sc\n0.080487 0.160975 0.887276 Sc\n0.919513 0.839025 0.112724 Sc\n0.639230 0.278458 0.250000 Sc\n0.919513 0.839025 0.387276 Sc\n0.214361 0.428723 0.082674 Fe\n0.785640 0.571277 0.582674 Fe\n0.214361 0.428723 0.417326 Fe\n0.785640 0.571277 0.917326 Fe\n0.330001 0.660003 0.250000 Si\n0.617280 0.234560 0.459077 Si\n0.617280 0.234560 0.040923 Si\n0.382720 0.765440 0.540923 Si\n0.669999 0.339997 0.750000 Si\n0.382720 0.765440 0.959077 Si\n",
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"volume": 252.8145077262757,
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{
"id": "jvasp-38195",
"created_at": "2022-09-04T14:37:50.378986Z",
"updated_at": "2022-09-04T14:37:50.379014Z",
"structure_string": "Rb4 Mg2\n1.0\n0.000000 0.000000 5.637623\n6.573768 3.795364 0.000000\n-1.145374 9.574577 0.000000\nRb Mg\n4 2\ndirect\n0.500000 0.366678 0.051527 Rb\n0.000000 0.915128 0.051528 Rb\n0.000000 0.633323 0.615138 Rb\n0.500000 0.084871 0.615139 Rb\n0.000000 0.390950 0.333334 Mg\n0.500000 0.609051 0.333334 Mg\n",
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{
"id": "jvasp-109098",
"created_at": "2022-09-04T14:37:50.613304Z",
"updated_at": "2022-09-04T14:37:50.613323Z",
"structure_string": "U2 Si2 Os4 C2\n1.0\n6.022476 -0.005150 0.000000\n-4.784291 3.657978 0.000000\n0.000000 0.000000 6.982984\nU Si Os C\n2 2 4 2\ndirect\n0.553680 0.446321 0.250000 U\n0.446322 0.553679 0.750000 U\n0.274659 0.725342 0.250000 Si\n0.725342 0.274659 0.750000 Si\n0.835923 0.164078 0.051638 Os\n0.164078 0.835923 0.948361 Os\n0.164078 0.835923 0.551638 Os\n0.835923 0.164078 0.448362 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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}