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=energy_above_hull&page=4193",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4191",
"results": [
{
"id": "jvasp-3306",
"created_at": "2022-09-04T14:35:47.371076Z",
"updated_at": "2022-09-04T14:35:47.371111Z",
"structure_string": "Si4 P4 Ru1\n1.0\n4.995881 0.004677 -0.000908\n-1.882224 -5.381032 -0.002553\n-2.309013 0.293744 -5.784150\nSi P Ru\n4 4 1\ndirect\n0.670610 0.224481 0.774033 Si\n0.237428 0.655832 0.567814 Si\n0.358537 0.405449 0.119002 Si\n0.844235 0.027844 0.310516 Si\n0.160070 0.983570 0.681091 P\n0.621624 0.588788 0.877532 P\n0.766715 0.357871 0.436428 P\n0.341226 0.772490 0.241186 P\n0.999458 0.001873 0.000896 Ru\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Si",
"P",
"Ru"
],
"chemical_system": "P-Ru-Si",
"density": 3.602932118254882,
"density_atomic": 0.05789273616102623,
"volume": 155.45991771691143,
"volume_molar": 10.40223896699176,
"formula_full": "Si4 P4 Ru1",
"formula_reduced": "Si4P4Ru",
"formula_anonymous": "AB4C4",
"energy_above_hull": 3.7644841,
"spacegroup": 1
},
{
"id": "jvasp-51638",
"created_at": "2022-09-04T14:38:36.619813Z",
"updated_at": "2022-09-04T14:38:36.619835Z",
"structure_string": "Ge12 N16\n1.0\n4.914313 -0.000000 0.000000\n0.000000 5.977230 0.000000\n0.000000 0.000000 10.100432\nGe N\n12 16\ndirect\n0.552538 0.750000 0.095964 Ge\n0.500000 0.500000 0.500000 Ge\n0.000000 0.500000 0.000000 Ge\n0.015965 0.750000 0.279521 Ge\n0.000000 0.000000 0.000000 Ge\n0.447462 0.250000 0.904036 Ge\n0.984034 0.250000 0.720478 Ge\n0.500000 0.000000 0.500000 Ge\n0.515965 0.250000 0.220478 Ge\n0.052538 0.250000 0.404036 Ge\n0.947461 0.750000 0.595964 Ge\n0.484034 0.750000 0.779521 Ge\n0.255565 0.004115 0.837627 N\n0.319375 0.750000 0.594562 N\n0.255565 0.495885 0.837627 N\n0.180625 0.750000 0.094562 N\n0.819375 0.250000 0.905437 N\n0.757714 0.750000 0.430752 N\n0.744435 0.995885 0.162373 N\n0.755564 0.504116 0.662373 N\n0.755564 0.995885 0.662373 N\n0.742285 0.750000 0.930752 N\n0.257715 0.250000 0.069248 N\n0.744435 0.504116 0.162373 N\n0.244435 0.004115 0.337627 N\n0.680625 0.250000 0.405437 N\n0.242285 0.250000 0.569248 N\n0.244435 0.495885 0.337627 N\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Ge",
"N"
],
"chemical_system": "Ge-N",
"density": 6.13299470849582,
"density_atomic": 0.09437463843112005,
"volume": 296.68987839816714,
"volume_molar": 6.381100749218021,
"formula_full": "Ge12 N16",
"formula_reduced": "Ge3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.7647758357142855,
"spacegroup": 62
},
{
"id": "jvasp-21507",
"created_at": "2022-09-04T14:38:09.593653Z",
"updated_at": "2022-09-04T14:38:09.593675Z",
"structure_string": "Er2 Co12 P7\n1.0\n4.507313 -7.806893 -0.000000\n4.507313 7.806893 0.000000\n0.000000 0.000000 3.577688\nEr Co P\n2 12 7\ndirect\n0.666667 0.333333 0.500000 Er\n0.333333 0.666667 0.000000 Er\n0.727019 0.846115 0.000000 Co\n0.382366 0.945276 0.500000 Co\n0.938933 0.563576 0.000000 Co\n0.624642 0.061066 0.000000 Co\n0.866395 0.104943 0.500000 Co\n0.436423 0.375358 0.000000 Co\n0.895056 0.761453 0.500000 Co\n0.054723 0.437089 0.500000 Co\n0.119096 0.272981 0.000000 Co\n0.562910 0.617633 0.500000 Co\n0.153884 0.880903 0.000000 Co\n0.238547 0.133604 0.500000 Co\n0.111784 0.708853 0.500000 P\n0.000000 0.000000 0.000000 P\n0.291146 0.402930 0.500000 P\n0.886244 0.292715 0.000000 P\n0.406470 0.113755 0.000000 P\n0.707285 0.593529 0.000000 P\n0.597069 0.888215 0.500000 P\n",
"nsites": 21,
"nelements": 3,
"elements": [
"Er",
"Co",
"P"
],
"chemical_system": "Co-Er-P",
"density": 8.300135607731017,
"density_atomic": 0.08340477018528931,
"volume": 251.78415998685787,
"volume_molar": 7.220379297996276,
"formula_full": "Er2 Co12 P7",
"formula_reduced": "Er2Co12P7",
"formula_anonymous": "A2B7C12",
"energy_above_hull": 3.7649890142857134,
"spacegroup": 174
},
{
"id": "jvasp-11434",
"created_at": "2022-09-04T14:37:14.604692Z",
"updated_at": "2022-09-04T14:37:14.604710Z",
"structure_string": "Ce1 Fe4 P12\n1.0\n6.394718 -0.000000 -2.260874\n-3.197359 5.537989 -2.260874\n-0.000000 -0.000000 6.782623\nCe Fe P\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Ce\n-0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.649869 0.498588 0.848719 P\n0.848719 0.350132 0.198852 P\n0.649869 0.801149 0.151282 P\n0.498588 0.848719 0.649869 P\n0.151281 0.649869 0.801149 P\n0.501413 0.151281 0.350132 P\n0.350132 0.501413 0.151281 P\n0.151281 0.350132 0.501413 P\n0.801149 0.151281 0.649869 P\n0.198852 0.848719 0.350132 P\n0.350132 0.198852 0.848719 P\n0.848719 0.649869 0.498588 P\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Ce",
"Fe",
"P"
],
"chemical_system": "Ce-Fe-P",
"density": 5.082440379812716,
"density_atomic": 0.07077465434777157,
"volume": 240.19898304929367,
"volume_molar": 8.508894625480592,
"formula_full": "Ce1 Fe4 P12",
"formula_reduced": "Ce(FeP3)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 3.765494911764706,
"spacegroup": 204
},
{
"id": "jvasp-34134",
"created_at": "2022-09-04T14:38:39.982950Z",
"updated_at": "2022-09-04T14:38:39.982975Z",
"structure_string": "Te7 Mo8 S9\n1.0\n-1.842386 -2.802569 -0.000059\n0.107490 -0.070510 14.266992\n-7.719368 9.088451 -0.102039\nTe Mo S\n7 8 9\ndirect\n0.812428 0.606972 0.812439 Te\n0.039163 0.600069 0.539182 Te\n0.544293 0.893469 0.044278 Te\n0.453155 0.400629 0.953139 Te\n0.320946 0.886149 0.320935 Te\n0.179846 0.119176 0.179855 Te\n0.955003 0.110804 0.455015 Te\n0.364426 0.243916 0.364424 Mo\n0.857513 0.266597 0.857512 Mo\n0.887469 0.745846 0.387474 Mo\n0.117688 0.253064 0.617691 Mo\n0.386837 0.747209 0.886832 Mo\n0.612291 0.258915 0.112285 Mo\n0.137561 0.761182 0.137562 Mo\n0.636445 0.733495 0.636445 Mo\n0.292087 0.648201 0.292104 S\n0.208415 0.356915 0.208396 S\n0.560310 0.654809 0.060322 S\n0.946261 0.349095 0.446247 S\n0.064115 0.839865 0.564106 S\n0.702764 0.149810 0.702777 S\n0.688050 0.365593 0.688037 S\n0.796517 0.845377 0.796500 S\n0.436440 0.162837 0.936448 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 5.91212268869155,
"density_atomic": 0.04383548191872779,
"volume": 547.5016801342956,
"volume_molar": 13.7380507671051,
"formula_full": "Te7 Mo8 S9",
"formula_reduced": "Te7Mo8S9",
"formula_anonymous": "A7B8C9",
"energy_above_hull": 3.766038398611111,
"spacegroup": 6
},
{
"id": "jvasp-34413",
"created_at": "2022-09-04T14:38:34.612157Z",
"updated_at": "2022-09-04T14:38:34.612184Z",
"structure_string": "Ta4 O10\n1.0\n3.698257 0.000000 0.000000\n-0.000000 6.493162 0.000000\n0.000000 0.000000 7.781408\nTa O\n4 10\ndirect\n0.500000 0.500000 0.500000 Ta\n0.500000 0.500000 0.000000 Ta\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 Ta\n0.500000 0.500000 0.750000 O\n-0.000001 0.320315 0.000000 O\n0.000000 0.000000 0.250000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.750000 O\n0.000001 0.679685 0.000000 O\n0.000001 0.320315 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.250000 O\n-0.000001 0.679685 0.500000 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ta",
"O"
],
"chemical_system": "O-Ta",
"density": 7.853883696950045,
"density_atomic": 0.0749232352357008,
"volume": 186.85792139057315,
"volume_molar": 8.037747890964617,
"formula_full": "Ta4 O10",
"formula_reduced": "Ta2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.7660594142857136,
"spacegroup": 47
},
{
"id": "jvasp-51565",
"created_at": "2022-09-04T14:37:43.309794Z",
"updated_at": "2022-09-04T14:37:43.309818Z",
"structure_string": "U4 Sn2 Rh4\n1.0\n7.628137 -0.000000 0.000000\n0.000000 7.628137 -0.000000\n0.000000 0.000000 3.586795\nU Sn Rh\n4 2 4\ndirect\n0.331613 0.168387 0.500001 U\n0.668387 0.831613 0.500001 U\n0.168387 0.668387 0.500001 U\n0.831613 0.331613 0.500001 U\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.000000 Sn\n0.635878 0.135877 0.000000 Rh\n0.864123 0.635878 0.000000 Rh\n0.364123 0.864123 0.000000 Rh\n0.135877 0.364123 0.000000 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"U",
"Sn",
"Rh"
],
"chemical_system": "Rh-Sn-U",
"density": 12.739126938500375,
"density_atomic": 0.04791334325436489,
"volume": 208.7101279263998,
"volume_molar": 12.568817684103864,
"formula_full": "U4 Sn2 Rh4",
"formula_reduced": "U2SnRh2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.76614394,
"spacegroup": 127
},
{
"id": "jvasp-104687",
"created_at": "2022-09-04T14:36:50.010725Z",
"updated_at": "2022-09-04T14:36:50.010750Z",
"structure_string": "Ta1 Mn2 Fe1 O6\n1.0\n4.645795 0.045963 3.124299\n1.687900 4.328569 3.124299\n0.066548 0.045963 5.598234\nTa Mn Fe O\n1 2 1 6\ndirect\n0.782632 0.782631 0.782633 Ta\n0.485006 0.485006 0.485007 Mn\n0.986463 0.986462 0.986464 Mn\n0.277020 0.277019 0.277020 Fe\n0.690165 0.063905 0.400121 O\n0.063906 0.400120 0.690165 O\n0.400120 0.690165 0.063906 O\n0.179908 0.880900 0.582678 O\n0.880900 0.582678 0.179909 O\n0.582679 0.179907 0.880900 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ta",
"Mn",
"Fe",
"O"
],
"chemical_system": "Fe-Mn-O-Ta",
"density": 6.632408190531463,
"density_atomic": 0.09022909498197301,
"volume": 110.82899592418512,
"volume_molar": 6.6742781374490905,
"formula_full": "Ta1 Mn2 Fe1 O6",
"formula_reduced": "TaMn2FeO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 3.7662220182758617,
"spacegroup": 146
},
{
"id": "jvasp-104761",
"created_at": "2022-09-04T14:36:58.147460Z",
"updated_at": "2022-09-04T14:36:58.147477Z",
"structure_string": "Al1 Si1 C1 N1\n1.0\n3.105406 -0.000000 0.000000\n-1.552702 2.689361 0.000000\n-0.000000 -0.000000 5.056396\nAl Si C N\n1 1 1 1\ndirect\n0.333334 0.666667 0.506769 Al\n0.666668 0.333333 0.997254 Si\n0.333334 0.666667 0.109163 C\n0.666668 0.333333 0.636816 N\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Al",
"Si",
"C",
"N"
],
"chemical_system": "Al-C-N-Si",
"density": 3.1884384822260974,
"density_atomic": 0.09472212267966224,
"volume": 42.22878338070478,
"volume_molar": 6.357691941053822,
"formula_full": "Al1 Si1 C1 N1",
"formula_reduced": "AlSiCN",
"formula_anonymous": "ABCD",
"energy_above_hull": 3.7674011625,
"spacegroup": 156
},
{
"id": "jvasp-70227",
"created_at": "2022-09-04T14:35:43.774584Z",
"updated_at": "2022-09-04T14:35:43.774606Z",
"structure_string": "Be2 Tc1 Os1\n1.0\n2.806563 0.000000 -0.000000\n0.000000 2.806563 0.000000\n0.000000 0.000000 5.695749\nBe Tc Os\n2 1 1\ndirect\n0.000000 0.000000 0.766188 Be\n0.000000 0.000000 0.233812 Be\n0.499999 0.499999 0.500000 Tc\n0.499999 0.499999 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Os"
],
"chemical_system": "Be-Os-Tc",
"density": 11.335246005723205,
"density_atomic": 0.08915784399308406,
"volume": 44.86425221666731,
"volume_molar": 6.754471048522815,
"formula_full": "Be2 Tc1 Os1",
"formula_reduced": "Be2TcOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7678546750000006,
"spacegroup": 123
},
{
"id": "jvasp-75885",
"created_at": "2022-09-04T14:35:50.334521Z",
"updated_at": "2022-09-04T14:35:50.334548Z",
"structure_string": "Zn1 Re2 As1\n1.0\n-0.000000 3.139130 3.139130\n3.139130 0.000000 3.139130\n3.139130 3.139130 0.000000\nZn Re As\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Zn\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Re\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Re",
"As"
],
"chemical_system": "As-Re-Zn",
"density": 13.762340314799422,
"density_atomic": 0.0646549963403893,
"volume": 61.86683514667901,
"volume_molar": 9.314269740725406,
"formula_full": "Zn1 Re2 As1",
"formula_reduced": "ZnRe2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7679445375,
"spacegroup": 216
},
{
"id": "jvasp-28528",
"created_at": "2022-09-04T14:37:27.521556Z",
"updated_at": "2022-09-04T14:37:27.521585Z",
"structure_string": "Mo2 W1 Se4 S2\n1.0\n3.282850 0.000000 0.000000\n-1.641426 2.839826 -0.135196\n0.000000 -0.978205 19.462306\nMo W Se S\n2 1 4 2\ndirect\n0.221861 0.443723 0.012683 Mo\n0.445942 0.891884 0.685440 Mo\n0.665506 0.331012 0.342809 W\n0.361499 0.723002 0.430431 Se\n0.750110 0.500222 0.598340 Se\n0.808418 0.616837 0.772493 Se\n0.302851 0.605706 0.255206 Se\n0.528642 0.057281 0.933398 S\n0.581772 0.163545 0.092038 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 6.932599858014419,
"density_atomic": 0.049721688751911235,
"volume": 181.0075286240967,
"volume_molar": 12.111697955489326,
"formula_full": "Mo2 W1 Se4 S2",
"formula_reduced": "Mo2W(Se2S)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.7687183629629626,
"spacegroup": 160
}
]
}