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=-formula_reduced&page=3640",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=3638",
"results": [
{
"id": "jvasp-100414",
"created_at": "2022-09-04T14:36:33.035387Z",
"updated_at": "2022-09-04T14:36:33.035396Z",
"structure_string": "Ce1 Pa1 O4\n1.0\n3.859481 0.000000 0.000000\n0.000000 3.859481 0.000000\n0.000000 0.000000 5.514441\nCe Pa O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Pa\n0.500000 0.000000 0.736978 O\n0.000000 0.500000 0.263022 O\n0.500000 0.000000 0.263022 O\n0.000000 0.500000 0.736978 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Pa",
"O"
],
"chemical_system": "Ce-O-Pa",
"density": 8.796871687408172,
"density_atomic": 0.07304524353452718,
"volume": 82.14087200850946,
"volume_molar": 8.244398223073132,
"formula_full": "Ce1 Pa1 O4",
"formula_reduced": "CePaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4181487666666666,
"spacegroup": 123
},
{
"id": "jvasp-52688",
"created_at": "2022-09-04T14:37:30.589843Z",
"updated_at": "2022-09-04T14:37:30.589866Z",
"structure_string": "Ce2 Pa2 O8\n1.0\n5.490109 -0.000200 -0.000347\n-0.000429 5.490073 -0.000364\n-2.744263 -2.744189 5.456452\nCe Pa O\n2 2 8\ndirect\n0.500000 0.500001 1.000000 Ce\n0.250001 0.749998 0.500000 Ce\n0.000001 -0.000002 0.000000 Pa\n0.749999 0.250002 0.500000 Pa\n0.112070 0.624999 0.750005 O\n0.637930 0.125001 0.750003 O\n0.112071 0.124998 0.749997 O\n0.374999 0.362070 0.250006 O\n0.637931 0.625000 0.749995 O\n0.875001 0.887930 0.250002 O\n0.375002 0.887930 0.249995 O\n0.875000 0.362069 0.249998 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ce",
"Pa",
"O"
],
"chemical_system": "Ce-O-Pa",
"density": 8.787724383218706,
"density_atomic": 0.07296928845800146,
"volume": 164.4527479106059,
"volume_molar": 8.25297996905387,
"formula_full": "Ce2 Pa2 O8",
"formula_reduced": "CePaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.417998766666667,
"spacegroup": 141
},
{
"id": "jvasp-107649",
"created_at": "2022-09-04T14:36:56.918260Z",
"updated_at": "2022-09-04T14:36:56.918291Z",
"structure_string": "Ce1 Pa3\n1.0\n4.686775 0.000000 0.000000\n0.000000 4.686775 0.000000\n0.000000 0.000000 4.686775\nCe Pa\n1 3\ndirect\n0.000000 0.000000 0.000000 Ce\n-0.000000 0.500001 0.500001 Pa\n0.500001 0.000000 0.500001 Pa\n0.500001 0.500001 -0.000000 Pa\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"Pa"
],
"chemical_system": "Ce-Pa",
"density": 13.439662619827976,
"density_atomic": 0.03885417369650436,
"volume": 102.94904303575173,
"volume_molar": 15.499340706714866,
"formula_full": "Ce1 Pa3",
"formula_reduced": "CePa3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.110621200000001,
"spacegroup": 221
},
{
"id": "jvasp-86628",
"created_at": "2022-09-04T14:35:44.576482Z",
"updated_at": "2022-09-04T14:35:44.576494Z",
"structure_string": "Ce2 P10\n1.0\n4.661078 -0.182027 0.000000\n-1.492841 5.369551 0.000000\n0.000000 0.000000 9.613280\nCe P\n2 10\ndirect\n0.415309 0.104063 0.250000 Ce\n0.584691 0.895936 0.750000 Ce\n0.230799 0.559485 0.250000 P\n0.769201 0.440514 0.750000 P\n0.133794 0.478955 0.906628 P\n0.866206 0.521044 0.406628 P\n0.866206 0.521044 0.093372 P\n0.133794 0.478955 0.593372 P\n0.212615 0.109688 0.946758 P\n0.787386 0.890311 0.446758 P\n0.787386 0.890311 0.053242 P\n0.212615 0.109688 0.553242 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 4.116459970835791,
"density_atomic": 0.05042273475541771,
"volume": 237.98788499290293,
"volume_molar": 11.943304521682943,
"formula_full": "Ce2 P10",
"formula_reduced": "CeP5",
"formula_anonymous": "AB5",
"energy_above_hull": 3.0606371666666665,
"spacegroup": 11
},
{
"id": "jvasp-85977",
"created_at": "2022-09-04T14:35:45.438210Z",
"updated_at": "2022-09-04T14:35:45.438238Z",
"structure_string": "Ce2 P10\n1.0\n4.660161 -0.182456 0.000000\n-1.493051 5.369551 0.000000\n0.000000 0.000000 9.613464\nCe P\n2 10\ndirect\n0.415150 0.103942 0.250000 Ce\n0.584850 0.896057 0.750000 Ce\n0.230740 0.559360 0.250000 P\n0.769259 0.440639 0.750000 P\n0.133882 0.479018 0.906636 P\n0.866118 0.520981 0.406636 P\n0.866118 0.520981 0.093364 P\n0.133882 0.479018 0.593363 P\n0.212611 0.109694 0.946713 P\n0.787389 0.890305 0.446713 P\n0.787389 0.890305 0.053286 P\n0.212611 0.109694 0.553286 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 4.117312981025795,
"density_atomic": 0.05043318332211312,
"volume": 237.9385795133506,
"volume_molar": 11.94083015053208,
"formula_full": "Ce2 P10",
"formula_reduced": "CeP5",
"formula_anonymous": "AB5",
"energy_above_hull": 3.0606355,
"spacegroup": 11
},
{
"id": "jvasp-10462",
"created_at": "2022-09-04T14:37:10.675016Z",
"updated_at": "2022-09-04T14:37:10.675045Z",
"structure_string": "Ce1 P12 Ru4\n1.0\n6.635795 0.000000 -2.346108\n-3.317898 5.746767 -2.346108\n-0.000000 -0.000000 7.038324\nCe P Ru\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.644914 0.501301 0.856387 P\n0.856388 0.355086 0.211473 P\n0.644914 0.788527 0.143613 P\n0.355086 0.211474 0.856387 P\n0.143613 0.644914 0.788526 P\n0.501301 0.856388 0.644913 P\n0.355086 0.498699 0.143613 P\n0.143613 0.355086 0.498699 P\n0.788527 0.143613 0.644913 P\n0.211474 0.856388 0.355086 P\n0.498699 0.143613 0.355086 P\n0.856388 0.644914 0.501301 P\n0.500000 0.500000 0.500000 Ru\n0.500000 -0.000000 -0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n-0.000000 0.500000 -0.000000 Ru\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Ce",
"P",
"Ru"
],
"chemical_system": "Ce-P-Ru",
"density": 5.667574482022356,
"density_atomic": 0.06333782068058808,
"volume": 268.4020355820389,
"volume_molar": 9.507969638503333,
"formula_full": "Ce1 P12 Ru4",
"formula_reduced": "Ce(P3Ru)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 4.079237264705883,
"spacegroup": 204
},
{
"id": "jvasp-35225",
"created_at": "2022-09-04T14:37:43.387665Z",
"updated_at": "2022-09-04T14:37:43.387684Z",
"structure_string": "Ce1 P12 Os4\n1.0\n-4.081542 -4.081542 4.081542\n-4.081542 4.081542 -4.081542\n4.081542 -4.081542 -4.081542\nCe P Os\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.211429 0.857072 0.354357 P\n0.788570 0.142927 0.645643 P\n0.497284 0.142927 0.354357 P\n0.502715 0.857072 0.645643 P\n0.645643 0.788570 0.142927 P\n0.354357 0.211429 0.857072 P\n0.645643 0.502715 0.857072 P\n0.857072 0.354357 0.211429 P\n0.142927 0.645643 0.788570 P\n0.142927 0.354357 0.497284 P\n0.857072 0.645643 0.502715 P\n0.354357 0.497284 0.142927 P\n0.000000 0.500000 0.000000 Os\n0.500000 0.500000 0.500000 Os\n0.500000 0.000000 0.000000 Os\n0.000000 0.000000 0.500000 Os\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Ce",
"P",
"Os"
],
"chemical_system": "Ce-Os-P",
"density": 7.77051057457753,
"density_atomic": 0.06250519587870364,
"volume": 271.97738941559146,
"volume_molar": 9.634624250576623,
"formula_full": "Ce1 P12 Os4",
"formula_reduced": "Ce(P3Os)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 4.515093029411765,
"spacegroup": 204
},
{
"id": "jvasp-29310",
"created_at": "2022-09-04T14:38:01.799865Z",
"updated_at": "2022-09-04T14:38:01.799891Z",
"structure_string": "Ce2 P6 H16 O14\n1.0\n7.074609 0.022088 -0.989754\n-2.449452 6.984078 -2.724684\n0.012596 0.081718 8.776429\nCe P H O\n2 6 16 14\ndirect\n0.346347 0.185831 0.128651 Ce\n0.653654 0.814170 0.871350 Ce\n0.850618 0.189939 0.274139 P\n0.149383 0.810062 0.725862 P\n0.033168 0.787061 0.205811 P\n0.966834 0.212940 0.794190 P\n0.466009 0.309818 0.591820 P\n0.533992 0.690183 0.408182 P\n0.848115 0.146159 0.418045 H\n0.151886 0.853842 0.581957 H\n0.047643 0.621988 0.231585 H\n0.952358 0.378013 0.768417 H\n0.044728 0.917264 0.367893 H\n0.955273 0.082737 0.632109 H\n0.727344 0.669443 0.414317 H\n0.553025 0.856288 0.372965 H\n0.272658 0.330558 0.585684 H\n0.135582 0.615281 0.668385 H\n0.685014 0.287880 0.967498 H\n0.314987 0.712121 0.032504 H\n0.446976 0.143713 0.627037 H\n0.864419 0.384720 0.331616 H\n0.327960 0.500820 0.949382 H\n0.672041 0.499181 0.050620 H\n0.627326 0.368827 0.049478 O\n0.495134 0.729792 0.581206 O\n0.381798 0.521832 0.263419 O\n0.618203 0.478169 0.736583 O\n0.172368 0.262742 0.906072 O\n0.827633 0.737259 0.093929 O\n0.782692 0.133514 0.849900 O\n0.217310 0.866487 0.150101 O\n0.347655 0.931937 0.855406 O\n0.652346 0.068064 0.144596 O\n0.964877 0.835826 0.785490 O\n0.035124 0.164175 0.214512 O\n0.372676 0.631174 0.950524 O\n0.504868 0.270209 0.418796 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Ce",
"P",
"H",
"O"
],
"chemical_system": "Ce-H-O-P",
"density": 2.689747753648991,
"density_atomic": 0.08716106213503187,
"volume": 435.97449444947733,
"volume_molar": 6.909209929854188,
"formula_full": "Ce2 P6 H16 O14",
"formula_reduced": "CeP3H8O7",
"formula_anonymous": "AB3C7D8",
"energy_above_hull": 3.147821921052632,
"spacegroup": 2
},
{
"id": "jvasp-100161",
"created_at": "2022-09-04T14:36:15.883316Z",
"updated_at": "2022-09-04T14:36:15.883339Z",
"structure_string": "Ce2 P6\n1.0\n5.787288 0.000000 0.000000\n-2.893644 5.011939 -0.000000\n-0.000000 0.000000 5.565257\nCe P\n2 6\ndirect\n0.333334 0.666667 0.750000 Ce\n0.666668 0.333333 0.250000 Ce\n0.199823 0.399645 0.250000 P\n0.600356 0.800178 0.250000 P\n0.199823 0.800178 0.250000 P\n0.800179 0.600355 0.750000 P\n0.399646 0.199822 0.750000 P\n0.800178 0.199822 0.750000 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 4.794445767972165,
"density_atomic": 0.04955915473696773,
"volume": 161.42325353326797,
"volume_molar": 12.15141943393134,
"formula_full": "Ce2 P6",
"formula_reduced": "CeP3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.5976380000000003,
"spacegroup": 194
},
{
"id": "jvasp-86682",
"created_at": "2022-09-04T14:36:02.241780Z",
"updated_at": "2022-09-04T14:36:02.241812Z",
"structure_string": "Ce4 P8\n1.0\n3.999389 0.000000 -0.507881\n0.000000 6.424073 0.000000\n0.075706 0.000000 9.683091\nCe P\n4 8\ndirect\n0.216077 0.315039 0.138322 Ce\n0.783924 0.684961 0.861678 Ce\n0.283924 0.815038 0.361678 Ce\n0.716077 0.184961 0.638322 Ce\n0.209052 0.855266 0.672278 P\n0.790949 0.144734 0.327722 P\n0.149292 0.368631 0.449385 P\n0.350708 0.868631 0.050615 P\n0.709051 0.644734 0.172278 P\n0.649293 0.131368 0.949385 P\n0.850709 0.631368 0.550616 P\n0.290950 0.355266 0.827722 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 5.389492933493165,
"density_atomic": 0.04818724988940213,
"volume": 249.02852990245395,
"volume_molar": 12.49737383607039,
"formula_full": "Ce4 P8",
"formula_reduced": "CeP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0464488333333337,
"spacegroup": 14
},
{
"id": "jvasp-86082",
"created_at": "2022-09-04T14:36:13.810852Z",
"updated_at": "2022-09-04T14:36:13.810876Z",
"structure_string": "Ce4 P8\n1.0\n3.999151 0.000000 -0.507796\n0.000000 6.424500 0.000000\n0.075760 0.000000 9.683119\nCe P\n4 8\ndirect\n0.216080 0.315075 0.138303 Ce\n0.783919 0.684925 0.861696 Ce\n0.283920 0.815075 0.361696 Ce\n0.716080 0.184925 0.638303 Ce\n0.209056 0.855238 0.672309 P\n0.790943 0.144762 0.327690 P\n0.149284 0.368621 0.449370 P\n0.350715 0.868622 0.050629 P\n0.709056 0.644762 0.172309 P\n0.649284 0.131379 0.949370 P\n0.850715 0.631379 0.550629 P\n0.290943 0.355238 0.827691 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 5.389436641314569,
"density_atomic": 0.04818674658318942,
"volume": 249.03113098294037,
"volume_molar": 12.497504370010533,
"formula_full": "Ce4 P8",
"formula_reduced": "CeP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0464455,
"spacegroup": 14
},
{
"id": "jvasp-20600",
"created_at": "2022-09-04T14:38:14.284821Z",
"updated_at": "2022-09-04T14:38:14.284839Z",
"structure_string": "Ce1 P1\n1.0\n3.537115 0.000000 2.042155\n1.179038 3.334824 2.042155\n-0.000000 -0.000000 4.084309\nCe P\n1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.499999 0.499999 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 5.8970176807743675,
"density_atomic": 0.04151349576382531,
"volume": 48.1771039321336,
"volume_molar": 14.506465064422901,
"formula_full": "Ce1 P1",
"formula_reduced": "CeP",
"formula_anonymous": "AB",
"energy_above_hull": 0.9399855,
"spacegroup": 225
}
]
}