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=534",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=532",
"results": [
{
"id": "jvasp-103883",
"created_at": "2022-09-04T14:36:55.635981Z",
"updated_at": "2022-09-04T14:36:55.636004Z",
"structure_string": "Ti1 H18 C10 O4\n1.0\n4.853474 0.105298 0.984339\n0.899336 6.539061 1.421801\n-0.221833 -0.099609 8.851490\nTi H C O\n1 18 10 4\ndirect\n0.252022 0.259730 0.813203 Ti\n0.429357 0.623734 0.126061 H\n0.481583 0.389806 0.253497 H\n0.945114 0.635280 0.087996 H\n0.000754 0.399109 0.210457 H\n0.870743 0.579803 0.675575 H\n0.004979 0.657836 0.360491 H\n0.696383 0.557971 0.434050 H\n0.223581 0.564966 0.577494 H\n0.129581 0.662718 0.758426 H\n0.423501 0.859063 0.280471 H\n-0.019469 0.920204 0.920738 H\n0.507418 0.881756 0.550871 H\n0.439639 0.117678 0.429004 H\n0.205189 0.955016 0.050068 H\n0.953155 0.133569 0.368623 H\n0.024250 0.897301 0.491158 H\n0.353117 0.853983 0.874061 H\n0.731329 0.958176 0.200652 H\n0.585030 0.486609 0.153369 C\n0.848584 0.540187 0.190904 C\n0.800583 0.650215 0.331191 C\n0.631260 0.866924 0.305449 C\n0.594576 0.977998 0.445092 C\n0.636486 0.376074 0.015577 C\n0.844906 0.141034 0.610032 C\n0.090084 0.552870 0.691267 C\n0.181602 0.959788 0.927889 C\n0.864605 0.033815 0.472163 C\n0.877574 0.328120 0.949266 O\n0.066012 0.169952 0.646009 O\n0.602278 0.198079 0.685502 O\n0.418065 0.336635 0.972123 O\n",
"nsites": 33,
"nelements": 4,
"elements": [
"Ti",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Ti",
"density": 1.4723824716468543,
"density_atomic": 0.11698941688630596,
"volume": 282.076797015498,
"volume_molar": 5.147594475022053,
"formula_full": "Ti1 H18 C10 O4",
"formula_reduced": "TiH18(C5O2)2",
"formula_anonymous": "AB4C10D18",
"energy_above_hull": 4.684402191919192,
"spacegroup": 1
},
{
"id": "jvasp-102413",
"created_at": "2022-09-04T14:36:46.090338Z",
"updated_at": "2022-09-04T14:36:46.090357Z",
"structure_string": "K1 Rb2 Ir1 F6\n1.0\n5.499080 -0.000000 3.174895\n1.833027 5.184582 3.174895\n-0.000000 -0.000000 6.349791\nK Rb Ir F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500001 K\n0.750001 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Ir\n0.773776 0.226225 0.226225 F\n0.226225 0.226225 0.773776 F\n0.226225 0.773775 0.773776 F\n0.226225 0.773775 0.226225 F\n0.773776 0.226225 0.773776 F\n0.773776 0.773775 0.226226 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Ir",
"F"
],
"chemical_system": "F-Ir-K-Rb",
"density": 4.735203444550971,
"density_atomic": 0.055237852181936206,
"volume": 181.03527934183842,
"volume_molar": 10.90219934722471,
"formula_full": "K1 Rb2 Ir1 F6",
"formula_reduced": "KRb2IrF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-104695",
"created_at": "2022-09-04T14:36:55.535697Z",
"updated_at": "2022-09-04T14:36:55.535728Z",
"structure_string": "Sm1 Mn1 Co3 Cu1\n1.0\n5.002144 0.000000 0.000000\n-2.501071 4.331984 0.000000\n0.000000 -0.000000 3.880781\nSm Mn Co Cu\n1 1 3 1\ndirect\n0.666666 0.333333 -0.000000 Sm\n0.333333 0.666666 -0.000000 Mn\n0.666034 0.833017 0.500000 Co\n0.166982 0.833017 0.500000 Co\n0.166983 0.333965 0.500000 Co\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Sm",
"Mn",
"Co",
"Cu"
],
"chemical_system": "Co-Cu-Mn-Sm",
"density": 8.799837074589542,
"density_atomic": 0.07134919560711557,
"volume": 84.09344981321173,
"volume_molar": 8.440376529485945,
"formula_full": "Sm1 Mn1 Co3 Cu1",
"formula_reduced": "SmMnCo3Cu",
"formula_anonymous": "ABCD3",
"energy_above_hull": 2.802111544396552,
"spacegroup": 187
},
{
"id": "jvasp-105002",
"created_at": "2022-09-04T14:36:46.099280Z",
"updated_at": "2022-09-04T14:36:46.099306Z",
"structure_string": "K2 Tl1 Ga1 Br6\n1.0\n6.873948 -0.000000 3.968676\n2.291316 6.480820 3.968676\n-0.000000 -0.000000 7.937351\nK Tl Ga Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Ga\n0.771855 0.228145 0.228146 Br\n0.228146 0.228145 0.771855 Br\n0.228146 0.771855 0.771855 Br\n0.228146 0.771855 0.228146 Br\n0.771855 0.228145 0.771855 Br\n0.771855 0.771855 0.228146 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Ga",
"Br"
],
"chemical_system": "Br-Ga-K-Tl",
"density": 3.905872456489797,
"density_atomic": 0.028280573505218044,
"volume": 353.59961841491304,
"volume_molar": 21.294266747768944,
"formula_full": "K2 Tl1 Ga1 Br6",
"formula_reduced": "K2TlGaBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-43150",
"created_at": "2022-09-04T14:36:40.968230Z",
"updated_at": "2022-09-04T14:36:40.968250Z",
"structure_string": "Li4 Cr4 Fe2 O12\n1.0\n4.963798 0.034409 0.000000\n-2.464739 4.308774 -0.000000\n-0.000000 0.000000 9.954226\nLi Cr Fe O\n4 4 2 12\ndirect\n0.148486 0.648486 0.750000 Li\n0.351514 0.851513 0.250000 Li\n0.648486 0.148486 0.750000 Li\n0.851514 0.351514 0.250000 Li\n0.161365 0.838633 0.500000 Cr\n0.338634 0.661365 0.000000 Cr\n0.661366 0.338634 0.000000 Cr\n0.838634 0.161366 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.506294 0.168491 0.394146 O\n0.823215 0.823215 0.397888 O\n0.331509 0.993706 0.894147 O\n0.676784 0.676784 0.897888 O\n0.323216 0.323215 0.102112 O\n0.006293 0.668490 0.105854 O\n0.493706 0.831509 0.605854 O\n0.168490 0.506293 0.394146 O\n0.993707 0.331509 0.894147 O\n0.831509 0.493706 0.605854 O\n0.176784 0.176784 0.602112 O\n0.668491 0.006294 0.105854 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Fe",
"O"
],
"chemical_system": "Cr-Fe-Li-O",
"density": 4.190744158665457,
"density_atomic": 0.1029268471808374,
"volume": 213.74403863111715,
"volume_molar": 5.850894032943024,
"formula_full": "Li4 Cr4 Fe2 O12",
"formula_reduced": "Li2Cr2FeO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.9986655727272726,
"spacegroup": 64
},
{
"id": "jvasp-107573",
"created_at": "2022-09-04T14:36:55.985908Z",
"updated_at": "2022-09-04T14:36:55.985938Z",
"structure_string": "Cd2 Ga1 Cu1 Te4\n1.0\n5.786796 0.039439 -5.236262\n-1.113631 5.678767 -5.236262\n-0.032231 -0.039439 7.804128\nCd Ga Cu Te\n2 1 1 4\ndirect\n0.750001 0.250000 0.500001 Cd\n0.250000 0.750000 0.500001 Cd\n0.500000 0.500000 0.000001 Ga\n0.000000 0.000000 0.000000 Cu\n0.642018 0.642018 0.509681 Te\n0.357983 0.867664 0.000001 Te\n0.132337 0.132337 0.490320 Te\n0.867664 0.357983 0.000001 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cd",
"Ga",
"Cu",
"Te"
],
"chemical_system": "Cd-Cu-Ga-Te",
"density": 5.6683415586154595,
"density_atomic": 0.031443550483343276,
"volume": 254.42419437454666,
"volume_molar": 19.152228890914003,
"formula_full": "Cd2 Ga1 Cu1 Te4",
"formula_reduced": "Cd2GaCuTe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.0,
"spacegroup": 121
},
{
"id": "jvasp-104916",
"created_at": "2022-09-04T14:36:46.109382Z",
"updated_at": "2022-09-04T14:36:46.109409Z",
"structure_string": "U2 Cu3 Si4 Ni1\n1.0\n3.970414 -0.000000 0.000000\n0.000000 3.970414 0.000000\n0.000000 0.000000 9.862410\nU Cu Si Ni\n2 3 4 1\ndirect\n0.500000 0.000000 0.753984 U\n-0.000000 0.500000 0.246016 U\n0.000000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n-0.000000 0.500000 0.873524 Si\n0.500000 0.000000 0.364290 Si\n0.500000 0.000000 0.126475 Si\n-0.000000 0.500000 0.635710 Si\n0.500000 0.500000 -0.000000 Ni\n",
"nsites": 10,
"nelements": 4,
"elements": [
"U",
"Cu",
"Si",
"Ni"
],
"chemical_system": "Cu-Ni-Si-U",
"density": 8.947447484378081,
"density_atomic": 0.06431989989850617,
"volume": 155.4728787790332,
"volume_molar": 9.36279560369755,
"formula_full": "U2 Cu3 Si4 Ni1",
"formula_reduced": "U2Cu3Si4Ni",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 2.868927015,
"spacegroup": 115
},
{
"id": "jvasp-43046",
"created_at": "2022-09-04T14:36:56.565735Z",
"updated_at": "2022-09-04T14:36:56.565756Z",
"structure_string": "Li4 Cr4 Sn4 O16\n1.0\n6.052721 -0.000000 0.000000\n-0.000000 6.052721 0.000000\n-0.000000 0.000000 8.458378\nLi Cr Sn O\n4 4 4 16\ndirect\n0.000000 0.235150 0.000000 Li\n0.000000 0.764850 0.500000 Li\n0.235150 0.000000 0.250000 Li\n0.764850 0.000000 0.750000 Li\n0.243789 0.500000 0.250000 Cr\n0.500000 0.243789 0.000000 Cr\n0.500000 0.756211 0.500000 Cr\n0.756211 0.500000 0.750000 Cr\n0.748883 0.748883 0.125000 Sn\n0.748883 0.251117 0.375000 Sn\n0.251117 0.748883 0.875000 Sn\n0.251117 0.251117 0.625000 Sn\n0.737141 0.974407 0.498944 O\n0.737141 0.025593 0.001056 O\n0.736640 0.479350 0.984776 O\n0.736640 0.520650 0.515224 O\n0.520650 0.736640 0.734776 O\n0.520650 0.263360 0.765224 O\n0.479350 0.736640 0.265224 O\n0.025593 0.737141 0.248944 O\n0.263360 0.520650 0.484776 O\n0.263360 0.479350 0.015224 O\n0.262859 0.974407 0.501056 O\n0.262859 0.025593 0.998944 O\n0.974407 0.262859 0.748944 O\n0.025593 0.262859 0.251056 O\n0.479350 0.263360 0.234776 O\n0.974407 0.737141 0.751056 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Sn",
"O"
],
"chemical_system": "Cr-Li-O-Sn",
"density": 5.179620752156476,
"density_atomic": 0.09035862853428178,
"volume": 309.8763278525956,
"volume_molar": 6.664710230429426,
"formula_full": "Li4 Cr4 Sn4 O16",
"formula_reduced": "LiCrSnO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.2544033000000008,
"spacegroup": 95
},
{
"id": "jvasp-47845",
"created_at": "2022-09-04T14:36:46.123818Z",
"updated_at": "2022-09-04T14:36:46.123830Z",
"structure_string": "Li6 Fe2 Si2 O10\n1.0\n4.980391 -0.003708 0.013668\n1.582554 5.386463 0.006629\n1.493537 1.081960 5.830725\nLi Fe Si O\n6 2 2 10\ndirect\n0.494156 0.249755 0.003142 Li\n0.317352 0.448640 0.397303 Li\n0.307429 0.948401 0.396231 Li\n0.692571 0.051598 0.603771 Li\n0.682647 0.551359 0.602699 Li\n0.505843 0.750244 -0.003142 Li\n0.905742 0.350126 0.204247 Fe\n0.094257 0.649873 0.795754 Fe\n0.101854 0.150497 0.780477 Si\n0.898146 0.849502 0.219525 Si\n0.353041 0.336630 0.718501 O\n0.645675 0.127302 0.284994 O\n0.646958 0.663369 0.281500 O\n0.159062 0.048401 0.096494 O\n0.002764 0.752919 0.485075 O\n0.163955 0.577132 0.104657 O\n0.836044 0.422867 0.895344 O\n-0.002764 0.247080 0.514926 O\n0.840938 0.951598 0.903507 O\n0.354325 0.872697 0.715008 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.9248196334095287,
"density_atomic": 0.1279337068000997,
"volume": 156.33096624997046,
"volume_molar": 4.707235419520657,
"formula_full": "Li6 Fe2 Si2 O10",
"formula_reduced": "Li3FeSiO5",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 2.25653116,
"spacegroup": 2
},
{
"id": "jvasp-105376",
"created_at": "2022-09-04T14:36:56.122152Z",
"updated_at": "2022-09-04T14:36:56.122172Z",
"structure_string": "Ti2 Fe1 Ni1 Sb2\n1.0\n4.014634 -0.001945 5.972276\n1.819311 3.578743 5.972276\n-0.003173 -0.001945 7.196205\nTi Fe Ni Sb\n2 1 1 2\ndirect\n0.371894 0.371893 0.371895 Ti\n0.878859 0.878855 0.878860 Ti\n0.997102 0.997098 0.997104 Fe\n0.501092 0.501089 0.501092 Ni\n0.123633 0.123633 0.123633 Sb\n0.627424 0.627421 0.627425 Sb\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Ti",
"Fe",
"Ni",
"Sb"
],
"chemical_system": "Fe-Ni-Sb-Ti",
"density": 7.279934987629389,
"density_atomic": 0.05796588030249533,
"volume": 103.50916726682938,
"volume_molar": 10.389112920520516,
"formula_full": "Ti2 Fe1 Ni1 Sb2",
"formula_reduced": "Ti2FeNiSb2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 2.738902794444445,
"spacegroup": 160
},
{
"id": "jvasp-105108",
"created_at": "2022-09-04T14:36:40.519549Z",
"updated_at": "2022-09-04T14:36:40.519577Z",
"structure_string": "Al1 Zn1 Cu3 Se4\n1.0\n5.719719 0.000000 0.000000\n0.000000 5.719719 0.000000\n-0.000000 -0.000000 5.719719\nAl Zn Cu Se\n1 1 3 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Zn\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.248592 0.248592 0.248592 Se\n0.751408 0.751408 0.248592 Se\n0.248592 0.751408 0.751408 Se\n0.751408 0.248592 0.751408 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Al",
"Zn",
"Cu",
"Se"
],
"chemical_system": "Al-Cu-Se-Zn",
"density": 5.314427859123078,
"density_atomic": 0.04809704888011651,
"volume": 187.12166774374865,
"volume_molar": 12.520811359986732,
"formula_full": "Al1 Zn1 Cu3 Se4",
"formula_reduced": "AlZnCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.5432431129629629,
"spacegroup": 215
},
{
"id": "jvasp-101762",
"created_at": "2022-09-04T14:36:40.266270Z",
"updated_at": "2022-09-04T14:36:40.266290Z",
"structure_string": "La2 Zn1 Fe1 O6\n1.0\n4.786104 -0.003797 2.609719\n1.547377 4.528529 2.610674\n-0.005179 -0.004877 5.451355\nLa Zn Fe O\n2 1 1 6\ndirect\n0.750882 0.750883 0.750885 La\n0.249118 0.249115 0.249117 La\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Fe\n0.304829 0.765437 0.173415 O\n0.765414 0.173411 0.304836 O\n0.173409 0.304839 0.765433 O\n0.695171 0.234563 0.826584 O\n0.826592 0.695160 0.234567 O\n0.234585 0.826588 0.695164 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Zn",
"Fe",
"O"
],
"chemical_system": "Fe-La-O-Zn",
"density": 6.949765479051879,
"density_atomic": 0.08453996019625078,
"volume": 118.28725701769949,
"volume_molar": 7.123425118748842,
"formula_full": "La2 Zn1 Fe1 O6",
"formula_reduced": "La2ZnFeO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.13939069,
"spacegroup": 148
}
]
}