HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4342",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4340",
"results": [
{
"id": "jvasp-48652",
"created_at": "2022-09-04T14:37:51.257482Z",
"updated_at": "2022-09-04T14:37:51.257508Z",
"structure_string": "Li7 V1 O5 F1\n1.0\n4.947642 0.061414 0.787391\n-2.413202 4.350716 -0.925570\n0.770991 -3.491585 6.509564\nLi V O F\n7 1 5 1\ndirect\n0.212687 0.384888 0.452521 Li\n0.416688 0.578322 0.207364 Li\n0.265772 0.694868 -0.070968 Li\n0.928634 0.576430 0.200418 Li\n0.436783 0.056685 0.706522 Li\n0.956104 0.026441 0.640183 Li\n0.731330 0.323249 0.429282 Li\n0.845074 0.829988 -0.099221 V\n0.166400 0.746903 0.442280 O\n0.144353 0.267347 0.941475 O\n0.564399 0.726318 0.720825 O\n0.829705 0.878706 0.164491 O\n0.890594 0.406204 0.700036 O\n0.507076 0.253153 0.212290 F\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 2.5545207477388394,
"density_atomic": 0.10848646729385895,
"volume": 129.04835367233395,
"volume_molar": 5.551052504721842,
"formula_full": "Li7 V1 O5 F1",
"formula_reduced": "Li7VO5F",
"formula_anonymous": "ABC5D7",
"energy_above_hull": 1.70030799875,
"spacegroup": 1
},
{
"id": "jvasp-29543",
"created_at": "2022-09-04T14:38:01.590556Z",
"updated_at": "2022-09-04T14:38:01.590583Z",
"structure_string": "Cd2 Sb4 Se6 Br4\n1.0\n4.028155 -0.000000 0.700091\n1.297396 9.728539 4.473659\n0.025315 -0.011317 11.792903\nCd Sb Se Br\n2 4 6 4\ndirect\n0.350683 0.846438 0.452196 Cd\n0.649318 0.153562 0.547803 Cd\n0.046400 0.688081 0.219121 Sb\n0.953601 0.311919 0.780879 Sb\n0.704923 0.683667 0.906487 Sb\n0.295078 0.316333 0.093513 Sb\n0.460656 0.864109 0.214582 Se\n0.900274 0.172034 0.027421 Se\n0.539345 0.135891 0.785417 Se\n0.678201 0.503410 0.140192 Se\n0.099727 0.827966 0.972579 Se\n0.321800 0.496590 0.859808 Se\n0.101987 0.342103 0.453922 Br\n0.898014 0.657897 0.546078 Br\n0.213496 0.923419 0.649590 Br\n0.786505 0.076581 0.350410 Br\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"Sb",
"Se",
"Br"
],
"chemical_system": "Br-Cd-Sb-Se",
"density": 5.408287678178538,
"density_atomic": 0.034619875054783415,
"volume": 462.16226877425675,
"volume_molar": 17.395038978247044,
"formula_full": "Cd2 Sb4 Se6 Br4",
"formula_reduced": "CdSb2Se3Br2",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 0.7118487825000002,
"spacegroup": 12
},
{
"id": "jvasp-26383",
"created_at": "2022-09-04T14:37:50.937705Z",
"updated_at": "2022-09-04T14:37:50.937723Z",
"structure_string": "K2 Li2 Zn2 O4\n1.0\n3.266551 -0.000037 0.754496\n1.417210 5.330220 1.312688\n0.001496 -0.002614 7.443889\nK Li Zn O\n2 2 2 4\ndirect\n0.162315 0.305953 0.369306 K\n0.837686 0.694047 0.630695 K\n0.658895 0.627409 0.054787 Li\n0.341106 0.372590 0.945214 Li\n0.954316 0.906660 0.184668 Zn\n0.045684 0.093339 0.815333 Zn\n0.537115 0.233820 0.692049 O\n0.462886 0.766180 0.307952 O\n0.163019 0.736166 0.937827 O\n0.836981 0.263834 0.062174 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Li",
"Zn",
"O"
],
"chemical_system": "K-Li-O-Zn",
"density": 3.67558998335208,
"density_atomic": 0.07715359970135903,
"volume": 129.61158051869683,
"volume_molar": 7.805391820096661,
"formula_full": "K2 Li2 Zn2 O4",
"formula_reduced": "KLiZnO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.29271908,
"spacegroup": 12
},
{
"id": "jvasp-25020",
"created_at": "2022-09-04T14:37:50.913912Z",
"updated_at": "2022-09-04T14:37:50.913928Z",
"structure_string": "I8 Cl8 O8 F8\n1.0\n0.000000 7.517596 0.058837\n7.042502 0.000000 0.000000\n0.000000 -1.070086 -12.730549\nI Cl O F\n8 8 8 8\ndirect\n0.309561 0.397783 0.414282 I\n0.643915 0.457845 0.218162 I\n0.356085 0.542155 0.781838 I\n0.143914 0.042155 0.218162 I\n0.190438 0.897783 0.585718 I\n0.856086 0.957845 0.781838 I\n0.690439 0.602217 0.585718 I\n0.809562 0.102217 0.414282 I\n0.715755 0.874902 0.936022 Cl\n0.539182 0.761188 0.155010 Cl\n0.460818 0.238812 0.844990 Cl\n0.039182 0.738812 0.155010 Cl\n0.784246 0.374902 0.063978 Cl\n0.284245 0.125097 0.063978 Cl\n0.960818 0.261188 0.844990 Cl\n0.215754 0.625097 0.936022 Cl\n0.770598 0.649015 0.722430 O\n0.270598 0.850985 0.722430 O\n0.039757 0.025655 0.395251 O\n0.460242 0.525654 0.604749 O\n0.229402 0.350985 0.277570 O\n0.539758 0.474345 0.395251 O\n0.960243 0.974345 0.604749 O\n0.729402 0.149015 0.277569 O\n0.417317 0.132681 0.424200 F\n0.582683 0.867319 0.575800 F\n0.082683 0.632680 0.575800 F\n0.741372 0.833034 0.392074 F\n0.258628 0.166966 0.607926 F\n0.917317 0.367319 0.424200 F\n0.758628 0.333034 0.607926 F\n0.241372 0.666966 0.392074 F\n",
"nsites": 32,
"nelements": 4,
"elements": [
"I",
"Cl",
"O",
"F"
],
"chemical_system": "Cl-F-I-O",
"density": 3.892427481407194,
"density_atomic": 0.04750974386272852,
"volume": 673.5460433644656,
"volume_molar": 12.675590879630862,
"formula_full": "I8 Cl8 O8 F8",
"formula_reduced": "IClOF",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.3395135312499999,
"spacegroup": 14
},
{
"id": "jvasp-109896",
"created_at": "2022-09-04T14:38:02.972727Z",
"updated_at": "2022-09-04T14:38:02.972754Z",
"structure_string": "Rb2 Tl1 Sb1 Br6\n1.0\n7.182185 -0.000000 4.146637\n2.394062 6.771429 4.146637\n-0.000000 -0.000000 8.293273\nRb Tl Sb Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Sb\n0.761142 0.238858 0.238858 Br\n0.238858 0.238858 0.761142 Br\n0.238858 0.761142 0.761142 Br\n0.238858 0.761142 0.238859 Br\n0.761142 0.238858 0.761142 Br\n0.761142 0.761142 0.238859 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Tl",
"Sb",
"Br"
],
"chemical_system": "Br-Rb-Sb-Tl",
"density": 4.020311982323994,
"density_atomic": 0.024793459051720673,
"volume": 403.33218447411423,
"volume_molar": 24.289231879414025,
"formula_full": "Rb2 Tl1 Sb1 Br6",
"formula_reduced": "Rb2TlSbBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-28804",
"created_at": "2022-09-04T14:38:03.118205Z",
"updated_at": "2022-09-04T14:38:03.118238Z",
"structure_string": "Te2 Mo3 W1 S6\n1.0\n3.276081 0.000000 -0.000000\n-1.638041 2.836959 -0.000545\n-0.000000 -0.007517 38.477884\nTe Mo W S\n2 3 1 6\ndirect\n0.333621 0.667242 0.709363 Te\n0.333418 0.666836 0.609389 Te\n0.333383 0.666765 0.093500 Mo\n0.666724 0.333449 0.282072 Mo\n0.666875 0.333751 0.659446 Mo\n0.333024 0.666048 0.467926 W\n0.333512 0.667026 0.322012 S\n0.666595 0.333190 0.053649 S\n0.666282 0.332566 0.427784 S\n0.666856 0.333711 0.133412 S\n0.666450 0.332901 0.508072 S\n0.333256 0.666513 0.242126 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 4.268387907818761,
"density_atomic": 0.03355539773691535,
"volume": 357.61757598833117,
"volume_molar": 17.946861507097722,
"formula_full": "Te2 Mo3 W1 S6",
"formula_reduced": "Te2Mo3WS6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 3.918652769444444,
"spacegroup": 156
},
{
"id": "jvasp-35434",
"created_at": "2022-09-04T14:37:39.977174Z",
"updated_at": "2022-09-04T14:37:39.977201Z",
"structure_string": "Sm2 Re2 Si2 C1\n1.0\n0.000000 -4.045357 -0.000000\n4.399909 -2.022679 -3.382588\n4.369139 -2.022679 3.702812\nSm Re Si C\n2 2 2 1\ndirect\n0.427795 0.843362 0.301049 Sm\n0.572206 0.156638 0.698951 Sm\n0.794583 0.320808 0.090028 Re\n0.205418 0.679192 0.909972 Re\n0.854410 0.601341 0.689840 Si\n0.145591 0.398660 0.310159 Si\n0.000000 0.000000 0.000000 C\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Sm",
"Re",
"Si",
"C"
],
"chemical_system": "C-Re-Si-Sm",
"density": 9.793541081427605,
"density_atomic": 0.05569106126594493,
"volume": 125.69342082695232,
"volume_molar": 10.813478183226035,
"formula_full": "Sm2 Re2 Si2 C1",
"formula_reduced": "Sm2Re2Si2C",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 4.680078707142857,
"spacegroup": 12
},
{
"id": "jvasp-109101",
"created_at": "2022-09-04T14:37:50.884005Z",
"updated_at": "2022-09-04T14:37:50.884027Z",
"structure_string": "Ho2 Mn4 Si2 C2\n1.0\n5.578188 0.000934 0.000000\n-4.360960 3.478248 0.000000\n-0.000000 -0.000000 6.952551\nHo Mn Si C\n2 4 2 2\ndirect\n0.543592 0.456408 0.250000 Ho\n0.456408 0.543592 0.750000 Ho\n0.831620 0.168379 0.061560 Mn\n0.168380 0.831621 0.938440 Mn\n0.168380 0.831621 0.561559 Mn\n0.831620 0.168379 0.438440 Mn\n0.264698 0.735302 0.250000 Si\n0.735302 0.264697 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ho",
"Mn",
"Si",
"C"
],
"chemical_system": "C-Ho-Mn-Si",
"density": 7.7511531310357125,
"density_atomic": 0.07411582778488701,
"volume": 134.9239467313769,
"volume_molar": 8.125309991110937,
"formula_full": "Ho2 Mn4 Si2 C2",
"formula_reduced": "HoMn2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.9479497298850577,
"spacegroup": 63
},
{
"id": "jvasp-109099",
"created_at": "2022-09-04T14:37:50.844246Z",
"updated_at": "2022-09-04T14:37:50.844271Z",
"structure_string": "Ba2 Pr1 Ta1 O6\n1.0\n5.327863 -0.000000 3.076043\n1.775954 5.023157 3.076043\n-0.000000 -0.000000 6.152086\nBa Pr Ta O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.750000 0.750000 Ba\n0.499999 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Ta\n0.769480 0.230519 0.230519 O\n0.230518 0.769481 0.769481 O\n0.230518 0.769481 0.230519 O\n0.769480 0.230519 0.769481 O\n0.230519 0.230519 0.769481 O\n0.769480 0.769481 0.230519 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Pr",
"Ta",
"O"
],
"chemical_system": "Ba-O-Pr-Ta",
"density": 6.984259947486129,
"density_atomic": 0.060736225786148554,
"volume": 164.64638476565645,
"volume_molar": 9.91523704683903,
"formula_full": "Ba2 Pr1 Ta1 O6",
"formula_reduced": "Ba2PrTaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.349323199,
"spacegroup": 225
},
{
"id": "jvasp-26418",
"created_at": "2022-09-04T14:37:50.732071Z",
"updated_at": "2022-09-04T14:37:50.732095Z",
"structure_string": "Pr1 Bi2 Cl1 O4\n1.0\n3.968266 0.000000 0.000000\n0.000000 3.968266 0.000000\n0.000000 -0.000000 9.091713\nPr Bi Cl O\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500001 0.500001 0.284941 Bi\n0.500001 0.500001 0.715059 Bi\n0.000000 0.000000 0.500000 Cl\n0.000000 0.500001 0.836115 O\n0.500001 0.000000 0.836115 O\n0.500001 0.000000 0.163885 O\n0.000000 0.500001 0.163885 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Pr",
"Bi",
"Cl",
"O"
],
"chemical_system": "Bi-Cl-O-Pr",
"density": 7.635513516173305,
"density_atomic": 0.05587823981112943,
"volume": 143.16843241734713,
"volume_molar": 10.777255655072645,
"formula_full": "Pr1 Bi2 Cl1 O4",
"formula_reduced": "PrBi2ClO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.6594333146874998,
"spacegroup": 123
},
{
"id": "jvasp-25631",
"created_at": "2022-09-04T14:37:39.890888Z",
"updated_at": "2022-09-04T14:37:39.890907Z",
"structure_string": "Na4 Nb8 P4 S40\n1.0\n7.454335 -0.000000 -2.360225\n-0.078552 13.033175 -0.248090\n0.017852 -0.065578 13.008063\nNa Nb P S\n4 8 4 40\ndirect\n0.937790 0.886294 0.884681 Na\n0.053110 0.613705 0.115319 Na\n0.946889 0.386294 0.884681 Na\n0.062209 0.113705 0.115319 Na\n0.418709 0.488042 0.716600 Nb\n0.297892 0.988042 0.716600 Nb\n0.572916 0.221259 0.282263 Nb\n0.427084 0.778740 0.717736 Nb\n0.290652 0.278740 0.717736 Nb\n0.702108 0.011957 0.283399 Nb\n0.709347 0.721259 0.282263 Nb\n0.581290 0.511957 0.283399 Nb\n0.205344 0.369290 0.207424 P\n0.002080 0.869290 0.207424 P\n-0.002080 0.130709 0.792576 P\n0.794655 0.630709 0.792575 P\n0.419136 0.904109 0.573536 S\n0.494337 0.134673 0.683955 S\n0.154400 0.404110 0.573537 S\n0.310297 0.423259 0.864926 S\n0.662149 0.369983 0.423610 S\n0.048865 0.738711 0.297919 S\n0.583029 0.636030 0.860162 S\n0.401525 0.356269 0.572015 S\n0.319453 0.853169 0.866243 S\n0.546789 0.353169 0.866242 S\n0.144242 0.872086 0.102099 S\n0.680546 0.146830 0.133757 S\n0.189618 0.634673 0.683955 S\n0.845599 0.595890 0.426463 S\n0.810382 0.365326 0.316044 S\n0.277133 0.136031 0.860162 S\n0.042143 0.627913 0.897901 S\n0.855757 0.127913 0.897900 S\n0.951134 0.261289 0.702081 S\n0.689702 0.576741 0.135073 S\n0.829510 0.143730 0.427984 S\n0.260091 0.501267 0.302357 S\n0.238539 0.130017 0.576389 S\n0.722867 0.863969 0.139837 S\n0.337851 0.630017 0.576389 S\n0.170489 0.856269 0.572016 S\n0.739908 0.498732 0.697642 S\n0.957734 0.998732 0.697642 S\n0.416971 0.363969 0.139838 S\n0.580863 0.095890 0.426463 S\n0.453210 0.646830 0.133757 S\n0.761461 0.869982 0.423610 S\n0.042266 0.001268 0.302357 S\n0.554628 0.923259 0.864926 S\n0.957857 0.372086 0.102099 S\n0.249053 0.238711 0.297918 S\n0.598474 0.643730 0.427984 S\n0.505663 0.865326 0.316045 S\n0.750946 0.761288 0.702081 S\n0.445371 0.076741 0.135074 S\n",
"nsites": 56,
"nelements": 4,
"elements": [
"Na",
"Nb",
"P",
"S"
],
"chemical_system": "Na-Nb-P-S",
"density": 2.9445097032485608,
"density_atomic": 0.04429690943814775,
"volume": 1264.1965480276542,
"volume_molar": 13.594945643801132,
"formula_full": "Na4 Nb8 P4 S40",
"formula_reduced": "NaNb2PS10",
"formula_anonymous": "ABC2D10",
"energy_above_hull": 2.789118092857142,
"spacegroup": 15
},
{
"id": "jvasp-29151",
"created_at": "2022-09-04T14:37:39.222120Z",
"updated_at": "2022-09-04T14:37:39.222146Z",
"structure_string": "Te4 Mo2 W2 Se4\n1.0\n3.444021 -0.000009 0.000033\n-1.722018 2.982620 -0.000141\n0.000357 -0.001550 36.292358\nTe Mo W Se\n4 2 2 4\ndirect\n0.333327 0.666733 0.716705 Te\n0.666650 0.333279 0.413714 Te\n0.666699 0.333424 0.516691 Te\n0.333306 0.666667 0.614286 Te\n0.333342 0.666624 0.096705 Mo\n0.666654 0.333370 0.665541 Mo\n0.333337 0.666681 0.465192 W\n0.666663 0.333316 0.275479 W\n0.333340 0.666695 0.320738 Se\n0.666668 0.333248 0.051692 Se\n0.666699 0.333355 0.141765 Se\n0.333310 0.666607 0.230241 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 6.1726465212526325,
"density_atomic": 0.03218866753547731,
"volume": 372.8020113530324,
"volume_molar": 18.70888489982566,
"formula_full": "Te4 Mo2 W2 Se4",
"formula_reduced": "Te2MoWSe2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.3787163611111115,
"spacegroup": 156
}
]
}