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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=1296",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=1294",
"results": [
{
"id": "jvasp-10880",
"created_at": "2022-09-04T14:37:16.128395Z",
"updated_at": "2022-09-04T14:37:16.128415Z",
"structure_string": "Rb4 Ta2 Cu2 S8\n1.0\n5.455859 -0.000000 1.280368\n2.727930 6.717892 0.640184\n0.025395 -0.000000 12.156127\nRb Ta Cu S\n4 2 2 8\ndirect\n0.803380 0.750000 0.393241 Rb\n0.446621 0.750000 0.106758 Rb\n0.196621 0.250000 0.606759 Rb\n0.553380 0.250000 0.893242 Rb\n0.625001 0.750000 0.750000 Ta\n0.375000 0.250000 0.250000 Ta\n0.125001 0.750000 0.750000 Cu\n0.875000 0.250000 0.250000 Cu\n0.090840 0.447256 0.139738 S\n0.177834 0.052744 0.360262 S\n0.822167 0.947255 0.639738 S\n0.909161 0.552744 0.860262 S\n0.230579 0.947255 0.860262 S\n0.538097 0.552744 0.639738 S\n0.461905 0.447256 0.360262 S\n0.769422 0.052744 0.139738 S\n",
"nsites": 16,
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"elements": [
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],
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"density": 4.054633527049116,
"density_atomic": 0.03592870524335801,
"volume": 445.32637320566545,
"volume_molar": 16.761363147405064,
"formula_full": "Rb4 Ta2 Cu2 S8",
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{
"id": "jvasp-11377",
"created_at": "2022-09-04T14:36:53.898282Z",
"updated_at": "2022-09-04T14:36:53.898308Z",
"structure_string": "Rb4 Ta2 Ag2 S8\n1.0\n5.768166 -0.000000 1.461187\n2.884083 6.750096 0.730594\n0.016995 -0.000000 12.048680\nRb Ta Ag S\n4 2 2 8\ndirect\n0.194358 0.250000 0.611284 Rb\n0.805643 0.750000 0.388715 Rb\n0.555644 0.250000 0.888715 Rb\n0.444357 0.750000 0.111284 Rb\n0.625000 0.750000 0.750000 Ta\n0.375000 0.250000 0.250000 Ta\n0.125000 0.750000 0.750000 Ag\n0.875001 0.250000 0.250000 Ag\n0.883642 0.546994 0.864871 S\n0.795505 0.953007 0.635129 S\n0.569367 0.546994 0.635129 S\n0.251489 0.953007 0.864870 S\n0.116358 0.453007 0.135129 S\n0.748512 0.046994 0.135129 S\n0.430634 0.453007 0.364871 S\n0.204496 0.046994 0.364871 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
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"Ag",
"S"
],
"chemical_system": "Ag-Rb-S-Ta",
"density": 4.164214414980178,
"density_atomic": 0.034118349989915746,
"volume": 468.9558552722822,
"volume_molar": 17.650738566724197,
"formula_full": "Rb4 Ta2 Ag2 S8",
"formula_reduced": "Rb2TaAgS4",
"formula_anonymous": "ABC2D4",
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"spacegroup": 70
},
{
"id": "jvasp-96633",
"created_at": "2022-09-04T14:36:17.366808Z",
"updated_at": "2022-09-04T14:36:17.366837Z",
"structure_string": "Rb4 Sn4 Se10\n1.0\n6.963724 0.044060 1.838880\n1.787409 6.730570 1.838880\n-0.064009 -0.049552 12.244433\nRb Sn Se\n4 4 10\ndirect\n0.593565 0.935292 0.321956 Rb\n0.064708 0.406435 0.178044 Rb\n0.406434 0.064708 0.678044 Rb\n0.935292 0.593566 0.821956 Rb\n0.748495 0.442885 0.558051 Sn\n0.251504 0.557115 0.441948 Sn\n0.442885 0.748496 0.058052 Sn\n0.557115 0.251504 0.941948 Sn\n0.241248 0.138888 0.963010 Se\n0.181521 0.818479 0.250000 Se\n0.758752 0.861112 0.036990 Se\n0.649394 0.378923 0.381139 Se\n0.621077 0.350605 0.118861 Se\n0.350605 0.621078 0.618861 Se\n0.378922 0.649394 0.881139 Se\n0.818478 0.181522 0.750000 Se\n0.138888 0.241248 0.463010 Se\n0.861112 0.758752 0.536990 Se\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"Se"
],
"chemical_system": "Rb-Se-Sn",
"density": 4.645409147313623,
"density_atomic": 0.03134856683352976,
"volume": 574.1889284950527,
"volume_molar": 19.210258612393233,
"formula_full": "Rb4 Sn4 Se10",
"formula_reduced": "Rb2Sn2Se5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 0.6930244703703703,
"spacegroup": 15
},
{
"id": "jvasp-58998",
"created_at": "2022-09-04T14:38:33.575521Z",
"updated_at": "2022-09-04T14:38:33.575556Z",
"structure_string": "Rb4 Sn4 I12\n1.0\n4.734465 -0.000000 0.000000\n0.000000 10.226607 0.000000\n0.000000 0.000000 17.306271\nRb Sn I\n4 4 12\ndirect\n0.250000 0.585614 0.827340 Rb\n0.250000 0.085613 0.672660 Rb\n0.749999 0.414387 0.172660 Rb\n0.749999 0.914387 0.327340 Rb\n0.749999 0.162416 0.940107 Sn\n0.250000 0.337584 0.440107 Sn\n0.250000 0.837584 0.059893 Sn\n0.749999 0.662416 0.559893 Sn\n0.250000 0.195392 0.286155 I\n0.749999 0.304608 0.786155 I\n0.250000 0.341589 0.007054 I\n0.749999 0.658412 0.992946 I\n0.250000 0.841589 0.492946 I\n0.250000 0.470711 0.618286 I\n0.250000 0.970712 0.881714 I\n0.749999 0.529289 0.381714 I\n0.749999 0.804609 0.713845 I\n0.250000 0.695392 0.213845 I\n0.749999 0.158411 0.507054 I\n0.749999 0.029289 0.118286 I\n",
"nsites": 20,
"nelements": 3,
"elements": [
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"Sn",
"I"
],
"chemical_system": "I-Rb-Sn",
"density": 4.636371273633486,
"density_atomic": 0.02386843908552685,
"volume": 837.9265995708716,
"volume_molar": 25.230559645819724,
"formula_full": "Rb4 Sn4 I12",
"formula_reduced": "RbSnI3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-36997",
"created_at": "2022-09-04T14:38:08.933922Z",
"updated_at": "2022-09-04T14:38:08.933938Z",
"structure_string": "Rb4 Sn4 Br12\n1.0\n4.510942 -0.000000 0.000000\n0.000000 9.368838 0.000000\n0.000000 0.000000 16.271703\nRb Sn Br\n4 4 12\ndirect\n0.750000 0.091053 0.329706 Rb\n0.250000 0.908947 0.670294 Rb\n0.750000 0.591053 0.170294 Rb\n0.250000 0.408947 0.829706 Rb\n0.250000 0.160905 0.062984 Sn\n0.750000 0.839095 0.937015 Sn\n0.250000 0.660905 0.437016 Sn\n0.750000 0.339095 0.562984 Sn\n0.750000 0.692793 0.788439 Br\n0.250000 0.307207 0.211561 Br\n0.750000 0.470648 0.376340 Br\n0.250000 0.529352 0.623660 Br\n0.750000 0.970648 0.123660 Br\n0.250000 0.660243 0.004392 Br\n0.250000 0.160243 0.495608 Br\n0.750000 0.839758 0.504392 Br\n0.250000 0.807207 0.288439 Br\n0.750000 0.339757 0.995608 Br\n0.250000 0.029352 0.876340 Br\n0.750000 0.192793 0.711561 Br\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"Br"
],
"chemical_system": "Br-Rb-Sn",
"density": 4.287442149405144,
"density_atomic": 0.02908332218153855,
"volume": 687.6793467802505,
"volume_molar": 20.70650912027761,
"formula_full": "Rb4 Sn4 Br12",
"formula_reduced": "RbSnBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-12925",
"created_at": "2022-09-04T14:37:12.118024Z",
"updated_at": "2022-09-04T14:37:12.118050Z",
"structure_string": "Rb4 Sn2 Te10\n1.0\n7.823149 -0.000000 -3.826935\n-1.872063 7.595857 -3.826935\n0.027198 0.034715 9.965240\nRb Sn Te\n4 2 10\ndirect\n0.246625 0.246625 0.493251 Rb\n0.746625 0.746625 0.493252 Rb\n0.996642 0.996641 0.993283 Rb\n0.496642 0.496641 0.993283 Rb\n0.746662 0.246662 0.493325 Sn\n0.246663 0.746662 0.493325 Sn\n0.454081 0.954080 0.266393 Te\n0.312313 0.454080 0.266393 Te\n0.954081 0.812313 0.266394 Te\n0.812313 0.312312 0.266393 Te\n0.180908 0.680907 0.720141 Te\n0.039233 0.180907 0.720140 Te\n0.680908 0.539233 0.720141 Te\n0.539233 0.039233 0.720140 Te\n0.496639 0.996639 0.993279 Te\n0.996639 0.496638 0.993278 Te\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"Te"
],
"chemical_system": "Rb-Sn-Te",
"density": 5.184337178948586,
"density_atomic": 0.02692477234816308,
"volume": 594.2482927285209,
"volume_molar": 22.366542907505234,
"formula_full": "Rb4 Sn2 Te10",
"formula_reduced": "Rb2SnTe5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 0.3799638166666667,
"spacegroup": 140
},
{
"id": "jvasp-10485",
"created_at": "2022-09-04T14:37:10.612164Z",
"updated_at": "2022-09-04T14:37:10.612183Z",
"structure_string": "Rb4 Sn2 Se6\n1.0\n7.129781 -0.049723 -0.046821\n3.130909 7.198435 0.055557\n2.744018 1.388785 8.406781\nRb Sn Se\n4 2 6\ndirect\n0.640348 0.467196 0.686653 Rb\n0.359652 0.532804 0.313348 Rb\n0.905159 0.797762 0.877980 Rb\n0.094841 0.202238 0.122020 Rb\n0.643753 0.937392 0.308522 Sn\n0.356246 0.062609 0.691478 Sn\n0.268233 0.946672 0.475723 Se\n0.731766 0.053328 0.524278 Se\n0.374573 0.808818 0.932411 Se\n0.625427 0.191182 0.067589 Se\n0.149438 0.398130 0.717553 Se\n0.850562 0.601870 0.282448 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Sn",
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],
"chemical_system": "Rb-Se-Sn",
"density": 4.039011789857415,
"density_atomic": 0.02771773779458387,
"volume": 432.9357644167063,
"volume_molar": 21.726667611296705,
"formula_full": "Rb4 Sn2 Se6",
"formula_reduced": "Rb2SnSe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.3450403,
"spacegroup": 2
},
{
"id": "jvasp-50821",
"created_at": "2022-09-04T14:35:56.549512Z",
"updated_at": "2022-09-04T14:35:56.549530Z",
"structure_string": "Rb4 Sn2 O6\n1.0\n5.347400 3.739597 0.000000\n-5.347400 3.739597 0.000000\n0.000000 0.000000 5.827336\nRb Sn O\n4 2 6\ndirect\n0.482856 0.804738 0.247965 Rb\n0.195263 0.517145 0.747966 Rb\n0.517145 0.195263 0.747966 Rb\n0.804738 0.482856 0.247965 Rb\n0.912056 0.912056 0.739546 Sn\n0.087945 0.087945 0.239546 Sn\n0.133505 0.879605 0.492937 O\n0.120396 0.866496 0.992937 O\n0.651018 0.651018 0.718649 O\n0.348983 0.348983 0.218648 O\n0.866496 0.120396 0.992937 O\n0.879605 0.133505 0.492937 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
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"O"
],
"chemical_system": "O-Rb-Sn",
"density": 4.811387576817712,
"density_atomic": 0.05148891212903894,
"volume": 233.0598861736717,
"volume_molar": 11.695995333728574,
"formula_full": "Rb4 Sn2 O6",
"formula_reduced": "Rb2SnO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.7739836999999999,
"spacegroup": 36
},
{
"id": "jvasp-10303",
"created_at": "2022-09-04T14:37:07.186735Z",
"updated_at": "2022-09-04T14:37:07.186759Z",
"structure_string": "Rb4 Sn2 As4\n1.0\n6.411261 -0.000000 -2.810181\n-1.409085 6.580193 -3.214745\n-0.008717 0.021606 8.698662\nRb Sn As\n4 2 4\ndirect\n0.855286 0.014692 0.710571 Rb\n0.644713 0.304119 0.289428 Rb\n0.144713 0.985308 0.289428 Rb\n0.355285 0.695881 0.710570 Rb\n0.250000 0.500000 -0.000001 Sn\n0.749999 0.500000 -0.000000 Sn\n0.394478 0.210662 0.788955 As\n0.105521 0.421705 0.211044 As\n0.605521 0.789338 0.211044 As\n0.894477 0.578295 0.788955 As\n",
"nsites": 10,
"nelements": 3,
"elements": [
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],
"chemical_system": "As-Rb-Sn",
"density": 3.973334121981435,
"density_atomic": 0.027222510991579546,
"volume": 367.3430420541733,
"volume_molar": 22.121915064568313,
"formula_full": "Rb4 Sn2 As4",
"formula_reduced": "Rb2SnAs2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5856990399999997,
"spacegroup": 72
},
{
"id": "jvasp-22894",
"created_at": "2022-09-04T14:38:19.543485Z",
"updated_at": "2022-09-04T14:38:19.543495Z",
"structure_string": "Rb4 Si6 Sn2 O18\n1.0\n3.517550 -6.092576 -0.000000\n3.517550 6.092576 -0.000000\n-0.000000 0.000000 10.177131\nRb Si Sn O\n4 6 2 18\ndirect\n0.333333 0.666667 0.940538 Rb\n0.666667 0.333333 0.440538 Rb\n0.333333 0.666667 0.559462 Rb\n0.666667 0.333333 0.059462 Rb\n0.134370 0.751749 0.250000 Si\n0.248251 0.382622 0.250000 Si\n0.382622 0.134370 0.750000 Si\n0.865630 0.248251 0.750000 Si\n0.617378 0.865629 0.250000 Si\n0.751749 0.617378 0.750000 Si\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n0.227447 0.255296 0.386181 O\n0.912473 0.506710 0.750000 O\n0.087527 0.493289 0.250000 O\n0.405762 0.912473 0.250000 O\n0.493289 0.405763 0.750000 O\n0.255296 0.027849 0.886181 O\n0.027849 0.772553 0.386181 O\n0.772553 0.744704 0.886181 O\n0.227447 0.255296 0.113819 O\n0.744704 0.972151 0.386181 O\n0.744704 0.972151 0.113819 O\n0.972151 0.227446 0.613819 O\n0.772553 0.744704 0.613819 O\n0.594238 0.087527 0.750000 O\n0.027849 0.772553 0.113819 O\n0.255296 0.027849 0.613819 O\n0.972151 0.227446 0.886181 O\n0.506711 0.594237 0.250000 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
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"Sn",
"O"
],
"chemical_system": "O-Rb-Si-Sn",
"density": 3.9429896913008946,
"density_atomic": 0.06877405941507868,
"volume": 436.2109820933809,
"volume_molar": 8.756413117413931,
"formula_full": "Rb4 Si6 Sn2 O18",
"formula_reduced": "Rb2Si3SnO9",
"formula_anonymous": "AB2C3D9",
"energy_above_hull": 2.2809066,
"spacegroup": 176
},
{
"id": "jvasp-99132",
"created_at": "2022-09-04T14:36:17.014748Z",
"updated_at": "2022-09-04T14:36:17.014774Z",
"structure_string": "Rb4 Si4 Bi4 S16\n1.0\n6.524203 0.000000 -0.316337\n0.000000 6.757537 0.000000\n-0.149012 0.000000 16.894253\nRb Si Bi S\n4 4 4 16\ndirect\n0.248187 0.244745 0.965477 Rb\n0.748186 0.255255 0.465477 Rb\n0.251814 0.744746 0.534522 Rb\n0.751813 0.755255 0.034522 Rb\n0.955085 0.268777 0.158661 Si\n0.455085 0.231223 0.658661 Si\n0.544914 0.768778 0.341339 Si\n0.044915 0.731223 0.841339 Si\n0.961870 0.286633 0.722777 Bi\n0.038129 0.713367 0.277222 Bi\n0.461870 0.213367 0.222778 Bi\n0.538129 0.786633 0.777222 Bi\n0.865734 0.992639 0.856110 S\n0.840836 0.494854 0.864762 S\n0.340837 0.005146 0.364762 S\n0.159163 0.505146 0.135238 S\n0.180592 0.240754 0.584582 S\n0.819408 0.759247 0.415418 S\n0.623748 0.813220 0.220146 S\n0.376251 0.186781 0.779853 S\n0.680592 0.259246 0.084582 S\n0.876251 0.313220 0.279853 S\n0.134265 0.007361 0.143889 S\n0.634265 0.492639 0.643889 S\n0.659163 0.994855 0.635237 S\n0.365734 0.507361 0.356111 S\n0.319408 0.740754 0.915418 S\n0.123749 0.686781 0.720146 S\n",
"nsites": 28,
"nelements": 4,
"elements": [
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"Si",
"Bi",
"S"
],
"chemical_system": "Bi-Rb-S-Si",
"density": 4.021775350007169,
"density_atomic": 0.037608751164552374,
"volume": 744.5075715885781,
"volume_molar": 16.012604974972124,
"formula_full": "Rb4 Si4 Bi4 S16",
"formula_reduced": "RbSiBiS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.6137032714285713,
"spacegroup": 14
},
{
"id": "jvasp-10885",
"created_at": "2022-09-04T14:37:16.832175Z",
"updated_at": "2022-09-04T14:37:16.832194Z",
"structure_string": "Rb4 Si2 S6\n1.0\n6.269881 0.000000 2.733008\n2.753423 6.538569 2.241756\n-0.014946 0.007693 8.592761\nRb Si S\n4 2 6\ndirect\n0.803775 0.579265 0.813184 Rb\n0.196224 0.420734 0.186817 Rb\n0.580416 0.200891 0.638275 Rb\n0.419583 0.799109 0.361726 Rb\n0.116369 0.947720 0.819542 Si\n0.883630 0.052280 0.180460 Si\n0.238228 -0.000000 0.000000 S\n0.761772 -0.000000 0.000000 S\n0.888469 0.827342 0.395719 S\n0.111530 0.172658 0.604282 S\n0.709877 0.357509 0.222735 S\n0.290122 0.642490 0.777266 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
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],
"chemical_system": "Rb-S-Si",
"density": 2.7814876383600913,
"density_atomic": 0.0340438954776377,
"volume": 352.4861015944077,
"volume_molar": 17.689340997876528,
"formula_full": "Rb4 Si2 S6",
"formula_reduced": "Rb2SiS3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.0786731,
"spacegroup": 12
}
]
}