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=-chemical_system&page=200",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=198",
"results": [
{
"id": "jvasp-37557",
"created_at": "2022-09-04T14:37:29.411597Z",
"updated_at": "2022-09-04T14:37:29.411618Z",
"structure_string": "Ti1 P3\n1.0\n-1.802954 1.802954 4.676033\n1.802954 -1.802954 4.676033\n1.802954 1.802954 -4.676033\nTi P\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.750000 0.500000 P\n0.750000 0.250000 0.500000 P\n0.500000 0.500000 0.000000 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"P"
],
"chemical_system": "P-Ti",
"density": 3.8451099920582767,
"density_atomic": 0.06578897797749898,
"volume": 60.80045811576632,
"volume_molar": 9.15372292614073,
"formula_full": "Ti1 P3",
"formula_reduced": "TiP3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.171581208333333,
"spacegroup": 139
},
{
"id": "jvasp-9091",
"created_at": "2022-09-04T14:36:47.381085Z",
"updated_at": "2022-09-04T14:36:47.381108Z",
"structure_string": "Th6 P8\n1.0\n7.090828 -0.000000 -2.506987\n-3.545414 6.140837 -2.506987\n-0.000000 -0.000000 7.520959\nTh P\n6 8\ndirect\n0.250001 0.625000 0.375000 Th\n0.375000 0.250000 0.625000 Th\n0.125001 0.750000 0.875000 Th\n0.875000 0.125000 0.750000 Th\n0.625001 0.375000 0.250000 Th\n0.750001 0.875000 0.125000 Th\n0.157431 0.157431 0.157431 P\n0.842569 0.500000 -0.000000 P\n0.000001 0.842569 0.500000 P\n0.500000 0.000000 0.842569 P\n0.000000 0.342569 0.500000 P\n0.500000 0.000000 0.342569 P\n0.342569 0.500000 -0.000000 P\n0.657432 0.657432 0.657431 P\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Th",
"P"
],
"chemical_system": "P-Th",
"density": 8.31572446674297,
"density_atomic": 0.04274942658838677,
"volume": 327.4897727821971,
"volume_molar": 14.087067922534342,
"formula_full": "Th6 P8",
"formula_reduced": "Th3P4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.3737384000000006,
"spacegroup": 220
},
{
"id": "jvasp-112476",
"created_at": "2022-09-04T14:38:40.462480Z",
"updated_at": "2022-09-04T14:38:40.462493Z",
"structure_string": "Th4 P8\n1.0\n3.881110 -0.000000 0.000000\n0.000000 7.230209 0.000000\n0.000000 0.000000 9.459084\nTh P\n4 8\ndirect\n0.250000 0.299828 0.847338 Th\n0.250000 0.799828 0.652661 Th\n0.750000 0.700172 0.152661 Th\n0.750000 0.200172 0.347339 Th\n0.250000 0.914542 0.960497 P\n0.250000 0.414541 0.539503 P\n0.750000 0.085459 0.039503 P\n0.750000 0.585459 0.460497 P\n0.250000 0.895954 0.339291 P\n0.250000 0.395954 0.160709 P\n0.750000 0.104046 0.660708 P\n0.750000 0.604046 0.839291 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Th",
"P"
],
"chemical_system": "P-Th",
"density": 7.356635491445828,
"density_atomic": 0.045209047867607634,
"volume": 265.4335927432354,
"volume_molar": 13.320653816102316,
"formula_full": "Th4 P8",
"formula_reduced": "ThP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.360645533333334,
"spacegroup": 62
},
{
"id": "jvasp-19901",
"created_at": "2022-09-04T14:36:58.655879Z",
"updated_at": "2022-09-04T14:36:58.655904Z",
"structure_string": "Th1 P1\n1.0\n3.598143 0.000000 2.077389\n1.199381 3.392362 2.077389\n0.000000 0.000000 4.154778\nTh P\n1 1\ndirect\n0.500000 0.500000 0.500001 Th\n0.000000 0.000000 0.000000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Th",
"P"
],
"chemical_system": "P-Th",
"density": 8.611839650807624,
"density_atomic": 0.03943679048589312,
"volume": 50.71406611335213,
"volume_molar": 15.270362232327631,
"formula_full": "Th1 P1",
"formula_reduced": "ThP",
"formula_anonymous": "AB",
"energy_above_hull": 1.3022705500000002,
"spacegroup": 225
},
{
"id": "jvasp-17452",
"created_at": "2022-09-04T14:38:15.001897Z",
"updated_at": "2022-09-04T14:38:15.001922Z",
"structure_string": "Zr2 Te2 P1\n1.0\n3.790569 0.006542 9.397978\n1.829219 3.320002 9.397978\n0.011053 0.006542 10.133620\nZr Te P\n2 2 1\ndirect\n0.617933 0.617932 0.617934 Zr\n0.382067 0.382066 0.382068 Zr\n0.220717 0.220717 0.220718 Te\n0.779283 0.779281 0.779284 Te\n0.000000 0.000000 0.000000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Te",
"P"
],
"chemical_system": "P-Te-Zr",
"density": 6.130057252768494,
"density_atomic": 0.03938791435787842,
"volume": 126.9424919169373,
"volume_molar": 15.289311094979174,
"formula_full": "Zr2 Te2 P1",
"formula_reduced": "Zr2Te2P",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.6275780066666665,
"spacegroup": 166
},
{
"id": "jvasp-12069",
"created_at": "2022-09-04T14:37:00.026935Z",
"updated_at": "2022-09-04T14:37:00.026960Z",
"structure_string": "Zr2 Te2 P1\n1.0\n3.790569 0.006542 9.397978\n1.829219 3.320002 9.397978\n0.011053 0.006542 10.133620\nZr Te P\n2 2 1\ndirect\n0.617933 0.617932 0.617934 Zr\n0.382067 0.382066 0.382068 Zr\n0.220717 0.220717 0.220718 Te\n0.779283 0.779281 0.779284 Te\n0.000000 0.000000 0.000000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Te",
"P"
],
"chemical_system": "P-Te-Zr",
"density": 6.130057252768494,
"density_atomic": 0.03938791435787842,
"volume": 126.9424919169373,
"volume_molar": 15.289311094979174,
"formula_full": "Zr2 Te2 P1",
"formula_reduced": "Zr2Te2P",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.6275780066666665,
"spacegroup": 166
},
{
"id": "jvasp-15768",
"created_at": "2022-09-04T14:36:53.579748Z",
"updated_at": "2022-09-04T14:36:53.579778Z",
"structure_string": "U2 Te2 P2\n1.0\n4.009814 0.000000 -0.938761\n-0.219779 4.003786 -0.938761\n-0.032340 -0.034164 8.894981\nU Te P\n2 2 2\ndirect\n0.889753 0.889755 0.779508 U\n0.110246 0.110247 0.220492 U\n0.315255 0.315256 0.630510 Te\n0.684744 0.684746 0.369490 Te\n-0.000000 0.500000 0.000000 P\n0.499999 -0.000000 0.000000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Te",
"P"
],
"chemical_system": "P-Te-U",
"density": 9.24011831026446,
"density_atomic": 0.042091466133159894,
"volume": 142.54670961136148,
"volume_molar": 14.307272502574396,
"formula_full": "U2 Te2 P2",
"formula_reduced": "UTeP",
"formula_anonymous": "ABC",
"energy_above_hull": 2.655659755555556,
"spacegroup": 139
},
{
"id": "jvasp-110294",
"created_at": "2022-09-04T14:37:53.483648Z",
"updated_at": "2022-09-04T14:37:53.483670Z",
"structure_string": "U2 Te2 P2\n1.0\n10.295428 0.064862 0.000000\n-9.540471 3.870331 0.000000\n0.000000 0.000000 4.002395\nU Te P\n2 2 2\ndirect\n0.593792 0.406208 0.500001 U\n0.406208 0.593792 0.500001 U\n0.836776 0.163223 -0.000000 Te\n0.163223 0.836776 -0.000000 Te\n0.500000 0.500000 -0.000000 P\n0.000000 0.000000 0.500001 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Te",
"P"
],
"chemical_system": "P-Te-U",
"density": 8.132602922397389,
"density_atomic": 0.037046406657181605,
"volume": 161.95902764666312,
"volume_molar": 16.255667697348947,
"formula_full": "U2 Te2 P2",
"formula_reduced": "UTeP",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6692797555555554,
"spacegroup": 65
},
{
"id": "jvasp-16763",
"created_at": "2022-09-04T14:38:07.628570Z",
"updated_at": "2022-09-04T14:38:07.628593Z",
"structure_string": "Ti2 Te2 P1\n1.0\n3.611363 0.009550 9.181548\n1.748561 3.159837 9.181548\n0.016151 0.009550 9.866230\nTi Te P\n2 2 1\ndirect\n0.379238 0.379239 0.379240 Ti\n0.620760 0.620761 0.620762 Ti\n0.775460 0.775462 0.775462 Te\n0.224538 0.224539 0.224539 Te\n0.000000 0.000000 0.000000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ti",
"Te",
"P"
],
"chemical_system": "P-Te-Ti",
"density": 5.672820318650482,
"density_atomic": 0.044726143163472926,
"volume": 111.79144112035607,
"volume_molar": 13.464475883800725,
"formula_full": "Ti2 Te2 P1",
"formula_reduced": "Ti2Te2P",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.46567754,
"spacegroup": 166
},
{
"id": "jvasp-101289",
"created_at": "2022-09-04T14:38:15.645313Z",
"updated_at": "2022-09-04T14:38:15.645334Z",
"structure_string": "Tc4 P12\n1.0\n3.139276 -0.000000 0.000000\n0.000000 5.183310 0.000000\n0.000000 0.000000 15.514215\nTc P\n4 12\ndirect\n0.250000 0.349933 0.650642 Tc\n0.750001 0.650067 0.349357 Tc\n0.750001 0.849933 0.849357 Tc\n0.250000 0.150067 0.150643 Tc\n0.250000 0.521621 0.793071 P\n0.750001 0.478379 0.206929 P\n0.750001 0.021621 0.706928 P\n0.250000 0.978379 0.293071 P\n0.250000 0.352615 0.012848 P\n0.750001 0.647385 0.987152 P\n0.750001 0.852615 0.487152 P\n0.250000 0.147385 0.512847 P\n0.250000 0.321982 0.381700 P\n0.750001 0.678018 0.618300 P\n0.750001 0.821982 0.118300 P\n0.250000 0.178018 0.881700 P\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Tc",
"P"
],
"chemical_system": "P-Tc",
"density": 5.0233906237217925,
"density_atomic": 0.06338018368254889,
"volume": 252.44483481049681,
"volume_molar": 9.501614558523498,
"formula_full": "Tc4 P12",
"formula_reduced": "TcP3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.479792,
"spacegroup": 62
},
{
"id": "jvasp-22454",
"created_at": "2022-09-04T14:38:32.833433Z",
"updated_at": "2022-09-04T14:38:32.833446Z",
"structure_string": "Tc8 P12\n1.0\n6.418202 -0.001074 0.003797\n-1.605027 6.166440 0.008280\n-1.586482 -1.190190 7.470326\nTc P\n8 12\ndirect\n0.907570 0.415762 0.147017 Tc\n0.092430 0.584239 0.852984 Tc\n0.373891 0.417754 0.138622 Tc\n0.626109 0.582247 0.861379 Tc\n0.532441 0.860067 0.361829 Tc\n0.467559 0.139934 0.638172 Tc\n0.083237 0.868951 0.370519 Tc\n0.916763 0.131050 0.629482 Tc\n0.459865 0.809827 0.034468 P\n0.540135 0.190174 0.965533 P\n0.629728 0.850684 0.678259 P\n0.370272 0.149317 0.321742 P\n0.140284 0.872557 0.683047 P\n0.264050 0.418982 0.641653 P\n0.764659 0.439530 0.616083 P\n0.235341 0.560470 0.383918 P\n0.033493 0.180973 0.957172 P\n0.735950 0.581019 0.358348 P\n0.859716 0.127444 0.316954 P\n0.966507 0.819028 0.042829 P\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Tc",
"P"
],
"chemical_system": "P-Tc",
"density": 6.488763891765317,
"density_atomic": 0.06762438667831497,
"volume": 295.7512959805279,
"volume_molar": 8.905279671735807,
"formula_full": "Tc8 P12",
"formula_reduced": "Tc2P3",
"formula_anonymous": "A2B3",
"energy_above_hull": 4.122815900000001,
"spacegroup": 2
},
{
"id": "jvasp-22910",
"created_at": "2022-09-04T14:37:29.968150Z",
"updated_at": "2022-09-04T14:37:29.968170Z",
"structure_string": "Tc12 P4\n1.0\n4.602824 0.000000 1.611017\n2.301411 6.753575 0.805510\n0.070332 -0.000003 7.179915\nTc P\n12 4\ndirect\n0.348233 0.651738 0.651673 Tc\n0.000091 0.651674 0.348262 Tc\n0.000026 0.348327 0.651737 Tc\n0.651645 0.348263 0.348327 Tc\n0.909083 0.000076 0.591897 Tc\n0.499018 0.591898 0.999924 Tc\n0.090840 0.408104 0.000075 Tc\n0.501055 0.999926 0.408103 Tc\n0.091447 0.000017 0.197517 Tc\n0.711035 0.197517 -0.000016 Tc\n0.908535 0.802483 0.000017 Tc\n0.288980 -0.000016 0.802482 Tc\n0.209097 0.290871 0.290956 P\n0.499946 0.290956 0.709129 P\n0.500031 0.709045 0.290871 P\n0.790922 0.709130 0.709044 P\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Tc",
"P"
],
"chemical_system": "P-Tc",
"density": 9.70446376777276,
"density_atomic": 0.07193398811076163,
"volume": 222.42614958819908,
"volume_molar": 8.371759884530944,
"formula_full": "Tc12 P4",
"formula_reduced": "Tc3P",
"formula_anonymous": "AB3",
"energy_above_hull": 4.757645,
"spacegroup": 121
}
]
}