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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=3827",
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{
"id": "jvasp-28392",
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"structure_string": "Si2 O4\n1.0\n3.809107 -0.000077 -0.000032\n0.000046 3.808720 -0.000089\n0.000020 0.000190 3.808749\nSi O\n2 4\ndirect\n0.809347 0.111254 0.918329 Si\n0.309358 0.611254 0.418326 Si\n0.559358 0.861255 0.668319 O\n0.059351 0.861267 0.168346 O\n0.559351 0.361248 0.168333 O\n0.059353 0.361260 0.668328 O\n",
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{
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{
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"structure_string": "Si4 O8\n1.0\n4.967681 0.000000 -0.000000\n-0.000000 4.967681 -0.000000\n0.000000 -0.000000 6.852277\nSi O\n4 8\ndirect\n0.689864 0.689864 0.500000 Si\n0.810136 0.189864 0.750000 Si\n0.189864 0.810136 0.250000 Si\n0.310136 0.310136 0.000000 Si\n0.876473 0.764840 0.311777 O\n0.123527 0.235159 0.811777 O\n0.764840 0.876473 0.688224 O\n0.264841 0.623527 0.061776 O\n0.235159 0.123527 0.188224 O\n0.376473 0.735159 0.438224 O\n0.623527 0.264841 0.938224 O\n0.735159 0.376473 0.561777 O\n",
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"volume": 169.09949492139978,
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"formula_full": "Si4 O8",
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"spacegroup": 92
},
{
"id": "jvasp-58385",
"created_at": "2022-09-04T14:37:30.268739Z",
"updated_at": "2022-09-04T14:37:30.268759Z",
"structure_string": "Si8 O16\n1.0\n7.071264 0.000000 0.000000\n-0.000000 7.071264 -0.000000\n0.000000 0.000000 7.071264\nSi O\n8 16\ndirect\n0.975434 0.524565 0.475434 Si\n0.524565 0.475434 0.975434 Si\n0.475434 0.975434 0.524565 Si\n0.024565 0.024565 0.024565 Si\n0.711377 0.788622 0.211377 Si\n0.788622 0.211377 0.711377 Si\n0.211377 0.711377 0.788622 Si\n0.288623 0.288623 0.288623 Si\n0.028521 0.638439 0.668963 O\n0.638439 0.668963 0.028521 O\n0.843704 0.656295 0.343705 O\n0.656295 0.343705 0.843704 O\n0.343705 0.843704 0.656295 O\n0.156295 0.156295 0.156295 O\n0.528521 0.861560 0.331036 O\n0.168963 0.471479 0.361560 O\n0.471479 0.361560 0.168963 O\n0.971478 0.138439 0.831036 O\n0.668963 0.028521 0.638439 O\n0.138439 0.831036 0.971478 O\n0.361560 0.168963 0.471479 O\n0.861560 0.331036 0.528521 O\n0.331036 0.528521 0.861560 O\n0.831036 0.971478 0.138439 O\n",
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"density": 2.257402156444883,
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"volume": 353.58281962995164,
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"formula_full": "Si8 O16",
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},
{
"id": "jvasp-58354",
"created_at": "2022-09-04T14:37:45.950484Z",
"updated_at": "2022-09-04T14:37:45.950501Z",
"structure_string": "Si4 O8\n1.0\n2.640730 -4.573880 0.000000\n2.640730 4.573880 0.000000\n0.000000 0.000000 8.618096\nSi O\n4 8\ndirect\n0.333333 0.666667 0.562416 Si\n0.666667 0.333333 0.062415 Si\n0.666667 0.333333 0.437585 Si\n0.333333 0.666667 0.937585 Si\n0.500000 0.500000 0.500000 O\n0.500000 -0.000000 0.000000 O\n-0.000000 0.500000 0.000000 O\n-0.000000 0.500000 0.500000 O\n0.333333 0.666667 0.750000 O\n0.666667 0.333333 0.250000 O\n0.500000 0.500000 0.000000 O\n0.500000 -0.000000 0.500000 O\n",
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"elements": [
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"density": 1.9169906996780022,
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"volume": 208.1853134834158,
"volume_molar": 10.447677183015466,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
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"energy_above_hull": 1.4022085333333338,
"spacegroup": 194
},
{
"id": "jvasp-34188",
"created_at": "2022-09-04T14:37:09.018801Z",
"updated_at": "2022-09-04T14:37:09.018821Z",
"structure_string": "Si6 O6\n1.0\n2.260048 -3.914518 0.000000\n2.260048 3.914518 -0.000000\n-0.000000 -0.000000 9.577221\nSi O\n6 6\ndirect\n0.500000 0.000000 0.274560 Si\n0.500000 0.000000 0.725440 Si\n0.000000 0.500000 0.058774 Si\n0.000000 0.500000 0.607893 Si\n0.500000 0.500000 0.941226 Si\n0.500000 0.500000 0.392107 Si\n0.336038 0.168020 0.833333 O\n0.831981 0.168020 0.166667 O\n0.831981 0.663963 0.500000 O\n0.168020 0.336038 0.500000 O\n0.168020 0.831981 0.166667 O\n0.663963 0.831981 0.833333 O\n",
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"elements": [
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"density_atomic": 0.07081345494051093,
"volume": 169.459321114624,
"volume_molar": 8.504232373719216,
"formula_full": "Si6 O6",
"formula_reduced": "SiO",
"formula_anonymous": "AB",
"energy_above_hull": 0.9342410499999998,
"spacegroup": 181
},
{
"id": "jvasp-34454",
"created_at": "2022-09-04T14:37:10.234979Z",
"updated_at": "2022-09-04T14:37:10.235006Z",
"structure_string": "Si4 O8\n1.0\n4.778095 0.000000 1.828704\n1.926448 6.440573 2.123047\n0.043719 -0.321925 7.042299\nSi O\n4 8\ndirect\n0.593101 0.257948 0.556519 Si\n0.407570 0.742050 0.443481 Si\n0.907570 0.943480 0.242051 Si\n0.093101 0.056519 0.757949 Si\n0.765609 0.148579 0.729798 O\n0.068299 -0.000000 -0.000000 O\n0.265608 0.229798 0.648580 O\n0.643986 0.851420 0.270201 O\n0.276861 0.848065 0.651934 O\n0.776861 0.151933 0.348066 O\n0.568300 0.499999 0.500000 O\n0.143985 0.770201 0.351421 O\n",
"nsites": 12,
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"density": 1.8278843851563766,
"density_atomic": 0.05496166418293202,
"volume": 218.33400022349616,
"volume_molar": 10.956984016998044,
"formula_full": "Si4 O8",
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"spacegroup": 46
},
{
"id": "jvasp-52128",
"created_at": "2022-09-04T14:37:10.417509Z",
"updated_at": "2022-09-04T14:37:10.417526Z",
"structure_string": "Si6 O6\n1.0\n2.260048 -3.914518 0.000000\n2.260048 3.914518 -0.000000\n0.000000 -0.000000 9.577221\nSi O\n6 6\ndirect\n0.500000 0.000000 0.274560 Si\n0.500000 0.000000 0.725440 Si\n0.000000 0.500000 0.058774 Si\n0.000000 0.500000 0.607893 Si\n0.500000 0.500000 0.941226 Si\n0.500000 0.500000 0.392107 Si\n0.336038 0.168020 0.833333 O\n0.831981 0.168020 0.166667 O\n0.831981 0.663963 0.500000 O\n0.168020 0.336038 0.500000 O\n0.168020 0.831981 0.166667 O\n0.663963 0.831981 0.833333 O\n",
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"formula_full": "Si6 O6",
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"energy_above_hull": 0.9342410499999998,
"spacegroup": 181
},
{
"id": "jvasp-34659",
"created_at": "2022-09-04T14:37:09.029476Z",
"updated_at": "2022-09-04T14:37:09.029496Z",
"structure_string": "Si4 O8\n1.0\n4.954618 -0.021621 -0.043016\n-1.532971 6.978970 -0.053275\n-1.786389 -3.447669 6.104939\nSi O\n4 8\ndirect\n0.795733 0.152513 0.284295 Si\n0.431674 0.152449 0.538713 Si\n0.821753 0.569161 0.619941 Si\n0.472735 0.871499 0.771027 Si\n0.689188 0.404326 0.707604 O\n0.621296 0.721749 0.619106 O\n0.789684 0.404382 0.367509 O\n0.174631 0.721770 0.773326 O\n0.722360 0.024961 0.022570 O\n0.376316 0.024827 0.672689 O\n0.549002 0.021902 0.346575 O\n0.124415 0.173400 0.421489 O\n",
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"volume": 209.21930310776574,
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"formula_full": "Si4 O8",
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"spacegroup": 5
},
{
"id": "jvasp-58267",
"created_at": "2022-09-04T14:37:18.266491Z",
"updated_at": "2022-09-04T14:37:18.266515Z",
"structure_string": "Si4 O8\n1.0\n4.107503 -0.000000 0.000000\n0.000000 4.531595 0.000000\n0.000000 0.000000 5.079692\nSi O\n4 8\ndirect\n0.500000 0.750001 0.652986 Si\n0.000000 0.250000 0.847014 Si\n0.500000 0.250000 0.347014 Si\n0.000000 0.750001 0.152986 Si\n0.268813 0.580416 0.382420 O\n0.768813 0.419585 0.117580 O\n0.231186 0.080416 0.117580 O\n0.731186 0.919585 0.382420 O\n0.268813 0.080416 0.617580 O\n0.768813 0.919585 0.882420 O\n0.231186 0.580416 0.882420 O\n0.731186 0.419585 0.617580 O\n",
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"formula_full": "Si4 O8",
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"spacegroup": 60
},
{
"id": "jvasp-34584",
"created_at": "2022-09-04T14:37:17.061284Z",
"updated_at": "2022-09-04T14:37:17.061305Z",
"structure_string": "Si4 O8\n1.0\n0.000000 4.330307 -0.002258\n4.254087 0.000000 0.000000\n0.000000 -0.518344 -7.930356\nSi O\n4 8\ndirect\n0.554106 0.417150 0.805349 Si\n0.862326 0.010323 0.321456 Si\n0.137675 0.010323 0.678544 Si\n0.445896 0.417150 0.194652 Si\n0.500000 0.329569 0.000000 O\n0.372380 0.771070 0.793909 O\n0.000000 0.850586 0.500000 O\n0.891372 0.225266 0.785461 O\n0.375088 0.282955 0.633676 O\n0.624914 0.282955 0.366325 O\n0.627622 0.771070 0.206092 O\n0.108629 0.225266 0.214540 O\n",
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"formula_full": "Si4 O8",
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"spacegroup": 3
},
{
"id": "jvasp-34660",
"created_at": "2022-09-04T14:37:14.401744Z",
"updated_at": "2022-09-04T14:37:14.401764Z",
"structure_string": "Si4 O8\n1.0\n5.132921 -0.058086 0.002983\n0.465633 5.246286 -0.017214\n1.927633 2.031113 6.444338\nSi O\n4 8\ndirect\n0.387064 0.717927 0.593142 Si\n0.439352 0.634001 0.049238 Si\n0.179965 0.275097 0.440889 Si\n0.864586 0.695428 0.247041 Si\n0.450197 0.634479 0.818121 O\n0.169052 0.962278 0.573446 O\n0.263074 0.457479 0.568121 O\n0.726034 0.740791 0.054916 O\n0.668087 0.829630 0.414078 O\n0.177671 0.809609 0.139953 O\n0.890929 0.381167 0.386404 O\n0.398429 0.330573 0.211972 O\n",
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"elements": [
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"volume": 173.8664515233552,
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"formula_full": "Si4 O8",
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"formula_anonymous": "AB2",
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"spacegroup": 1
}
]
}