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=543",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=541",
"results": [
{
"id": "jvasp-107149",
"created_at": "2022-09-04T14:36:55.961705Z",
"updated_at": "2022-09-04T14:36:55.961714Z",
"structure_string": "Ce2 Cu1 N2 O2\n1.0\n3.726769 -0.006935 -5.421812\n-0.365081 3.708850 -5.421812\n0.006298 0.006935 6.579120\nCe Cu N O\n2 1 2 2\ndirect\n0.640458 0.640457 -0.000000 Ce\n0.359542 0.359541 -0.000000 Ce\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500001 0.500001 N\n0.500000 -0.000000 0.500001 N\n0.250001 0.750000 0.500001 O\n0.750001 0.250000 0.500000 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Ce",
"Cu",
"N",
"O"
],
"chemical_system": "Ce-Cu-N-O",
"density": 7.352007902300227,
"density_atomic": 0.07675366695405016,
"volume": 91.2008543408182,
"volume_molar": 7.846062603895202,
"formula_full": "Ce2 Cu1 N2 O2",
"formula_reduced": "Ce2Cu(NO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 2.8150649928571427,
"spacegroup": 139
},
{
"id": "jvasp-103987",
"created_at": "2022-09-04T14:36:47.864575Z",
"updated_at": "2022-09-04T14:36:47.864588Z",
"structure_string": "Cd1 H20 C12 O4\n1.0\n3.895308 -0.110980 -0.548034\n-0.890648 4.241458 -0.158020\n-0.685650 0.048134 17.528757\nCd H C O\n1 20 12 4\ndirect\n0.614107 0.113797 0.156907 Cd\n0.963574 0.745308 0.453534 H\n0.928595 0.259503 0.369656 H\n0.082989 0.248691 0.968052 H\n0.685435 0.233844 0.807528 H\n0.147030 0.266642 0.830881 H\n0.751443 0.214898 0.660595 H\n0.213306 0.264970 0.690251 H\n0.830789 0.222265 0.515759 H\n0.289244 0.263310 0.548982 H\n0.653860 0.307024 0.963944 H\n0.375021 0.266894 0.408631 H\n0.773496 0.763019 0.882951 H\n0.234076 0.787600 0.904380 H\n0.783935 0.727814 0.735638 H\n0.246754 0.780753 0.763527 H\n0.855780 0.724624 0.593118 H\n0.316713 0.776695 0.624010 H\n0.111517 0.783527 0.313412 H\n0.556806 0.813832 0.356604 H\n0.419560 0.780619 0.487196 H\n0.069141 0.628318 0.042120 C\n-0.069755 0.433703 0.965133 C\n0.972795 0.619068 0.893021 C\n0.944552 0.407345 0.819933 C\n0.995394 0.597543 0.748870 C\n0.003368 0.396522 0.676529 C\n0.187792 0.419826 0.393789 C\n0.084306 0.399586 0.534483 C\n0.165231 0.605441 0.467432 C\n0.306300 0.642379 0.332359 C\n0.361854 0.482696 0.259619 C\n0.066208 0.593798 0.607127 C\n-0.051378 0.537952 0.102193 O\n0.597719 0.624221 0.223321 O\n0.184916 0.197282 0.236673 O\n0.320256 0.878558 0.043720 O\n",
"nsites": 37,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 1.9758890800957247,
"density_atomic": 0.1292255555577824,
"volume": 286.3210751178058,
"volume_molar": 4.660177883551243,
"formula_full": "Cd1 H20 C12 O4",
"formula_reduced": "CdH20(C3O)4",
"formula_anonymous": "AB4C12D20",
"energy_above_hull": 4.595727128378379,
"spacegroup": 1
},
{
"id": "jvasp-49150",
"created_at": "2022-09-04T14:37:03.509488Z",
"updated_at": "2022-09-04T14:37:03.509517Z",
"structure_string": "Tm2 Ag2 P4 Se12\n1.0\n3.301944 -5.719134 -0.000000\n3.301944 5.719134 -0.000000\n-0.000000 0.000000 13.493771\nTm Ag P Se\n2 2 4 12\ndirect\n0.000000 0.000000 0.750000 Tm\n0.000000 0.000000 0.250000 Tm\n0.333333 0.666666 0.750000 Ag\n0.666666 0.333333 0.250000 Ag\n0.666666 0.333333 0.665305 P\n0.666666 0.333333 0.834695 P\n0.333333 0.666666 0.334695 P\n0.333333 0.666666 0.165305 P\n0.980720 0.320393 0.616140 Se\n0.980720 0.660327 0.883860 Se\n0.679605 0.019279 0.883860 Se\n0.339672 0.320394 0.883860 Se\n0.320394 0.339672 0.383860 Se\n0.320393 0.980720 0.116140 Se\n0.019279 0.679605 0.383860 Se\n0.019279 0.339672 0.116140 Se\n0.339672 0.019279 0.616140 Se\n0.660327 0.679605 0.116140 Se\n0.660327 0.980720 0.383860 Se\n0.679605 0.660327 0.616140 Se\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Tm",
"Ag",
"P",
"Se"
],
"chemical_system": "Ag-P-Se-Tm",
"density": 5.294737889613666,
"density_atomic": 0.03924340556995312,
"volume": 509.6397651918641,
"volume_molar": 15.34561201439377,
"formula_full": "Tm2 Ag2 P4 Se12",
"formula_reduced": "TmAg(PSe3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.7876482709999997,
"spacegroup": 163
},
{
"id": "jvasp-105459",
"created_at": "2022-09-04T14:36:55.916051Z",
"updated_at": "2022-09-04T14:36:55.916075Z",
"structure_string": "Li2 V1 Cr1 S4\n1.0\n6.219764 -0.000436 3.031574\n5.254084 3.328674 3.031574\n0.009886 0.002868 6.112047\nLi V Cr S\n2 1 1 4\ndirect\n0.249667 0.249667 0.750628 Li\n0.750334 0.750332 0.249371 Li\n0.500000 0.499999 0.500000 V\n0.000000 0.000000 0.000000 Cr\n0.885718 0.885716 0.784649 S\n0.386693 0.386692 0.278407 S\n0.114282 0.114282 0.215350 S\n0.613308 0.613306 0.721593 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"V",
"Cr",
"S"
],
"chemical_system": "Cr-Li-S-V",
"density": 3.2184570369663077,
"density_atomic": 0.0632676120356705,
"volume": 126.44700412415713,
"volume_molar": 9.518520718949686,
"formula_full": "Li2 V1 Cr1 S4",
"formula_reduced": "Li2VCrS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.4912164500000005,
"spacegroup": 12
},
{
"id": "jvasp-101967",
"created_at": "2022-09-04T14:37:02.135688Z",
"updated_at": "2022-09-04T14:37:02.135697Z",
"structure_string": "Cd1 H20 C12 O4\n1.0\n4.007552 0.063583 0.101066\n1.006004 4.204570 0.045652\n-0.271822 0.023092 16.853480\nCd H C O\n1 20 12 4\ndirect\n0.325071 0.953537 0.857146 Cd\n0.702700 0.693036 0.514784 H\n0.828862 0.165146 0.588874 H\n0.426208 0.782179 0.015445 H\n0.202924 0.345056 0.145520 H\n0.794153 0.369845 0.188163 H\n0.436286 0.264405 0.293435 H\n0.011189 0.317018 0.329097 H\n0.643390 0.208542 0.440006 H\n0.212828 0.272659 0.472757 H\n0.587566 0.389172 0.053666 H\n0.391008 0.242222 0.617683 H\n0.979097 0.899116 0.086149 H\n0.584558 0.926383 0.134986 H\n0.266209 0.808873 0.227851 H\n0.844131 0.859093 0.264638 H\n0.494719 0.744284 0.370215 H\n0.065696 0.807407 0.403713 H\n0.899557 0.640848 0.662882 H\n0.451032 0.752224 0.685207 H\n0.268159 0.768486 0.545032 H\n0.905097 0.532294 0.965606 C\n0.659094 0.608520 0.035427 C\n0.803509 0.755108 0.106879 C\n0.974187 0.514747 0.170420 C\n0.072728 0.676181 0.243965 C\n0.206210 0.448178 0.312848 C\n0.598990 0.359057 0.602445 C\n0.413693 0.397855 0.457012 C\n0.495873 0.573905 0.529733 C\n0.671536 0.547502 0.674527 C\n0.738808 0.341103 0.748424 C\n0.294534 0.618373 0.385974 C\n0.135780 0.273529 0.965528 O\n0.528266 0.407541 0.807374 O\n-0.002055 0.101283 0.747872 O\n0.871201 0.743985 0.909429 O\n",
"nsites": 37,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 1.9989600393746378,
"density_atomic": 0.13073442443109184,
"volume": 283.01650587448864,
"volume_molar": 4.606392529133885,
"formula_full": "Cd1 H20 C12 O4",
"formula_reduced": "CdH20(C3O)4",
"formula_anonymous": "AB4C12D20",
"energy_above_hull": 4.595870101351352,
"spacegroup": 1
},
{
"id": "jvasp-105531",
"created_at": "2022-09-04T14:36:55.952263Z",
"updated_at": "2022-09-04T14:36:55.952287Z",
"structure_string": "Ce1 Th1 C1 N1\n1.0\n3.716196 0.000000 0.000000\n0.000000 3.716196 0.000000\n0.000000 0.000000 5.159973\nCe Th C N\n1 1 1 1\ndirect\n0.000000 0.000000 0.500000 Ce\n0.500001 0.500001 -0.000000 Th\n0.000000 0.000000 0.000000 C\n0.500001 0.500001 0.500000 N\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Ce",
"Th",
"C",
"N"
],
"chemical_system": "C-Ce-N-Th",
"density": 9.278431650031806,
"density_atomic": 0.05613262331543315,
"volume": 71.25980871270338,
"volume_molar": 10.728414964964353,
"formula_full": "Ce1 Th1 C1 N1",
"formula_reduced": "CeThCN",
"formula_anonymous": "ABCD",
"energy_above_hull": 3.9137235875,
"spacegroup": 123
},
{
"id": "jvasp-106772",
"created_at": "2022-09-04T14:37:03.432930Z",
"updated_at": "2022-09-04T14:37:03.432940Z",
"structure_string": "Mn1 Zn1 Cd1 Te3\n1.0\n4.388467 0.009273 -9.064689\n-0.221299 4.372102 -9.069899\n-0.008769 -0.009273 10.071105\nMn Zn Cd Te\n1 1 1 3\ndirect\n0.670536 0.670535 -0.000001 Mn\n0.330332 0.330331 -0.000000 Zn\n0.998739 0.998737 -0.000001 Cd\n0.751732 0.251731 0.500000 Te\n0.090572 0.590572 0.500000 Te\n0.408093 0.908093 0.499999 Te\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Mn",
"Zn",
"Cd",
"Te"
],
"chemical_system": "Cd-Mn-Te-Zn",
"density": 5.309396531982258,
"density_atomic": 0.031165801701741228,
"volume": 192.5187119336892,
"volume_molar": 19.3229130366428,
"formula_full": "Mn1 Zn1 Cd1 Te3",
"formula_reduced": "MnZnCdTe3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.5994267818965516,
"spacegroup": 44
},
{
"id": "jvasp-105534",
"created_at": "2022-09-04T14:36:51.679260Z",
"updated_at": "2022-09-04T14:36:51.679284Z",
"structure_string": "Ce1 B2 Ir2 Rh1\n1.0\n5.477139 0.006862 0.000000\n-2.731071 4.747668 0.000000\n0.000000 -0.000000 3.177711\nCe B Ir Rh\n1 2 2 1\ndirect\n0.500000 0.500000 -0.000000 Ce\n0.166976 0.833025 -0.000000 B\n0.833024 0.166975 -0.000000 B\n0.000000 0.500000 0.500000 Ir\n0.500000 -0.000000 0.500000 Ir\n0.000000 0.000000 0.500000 Rh\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Ce",
"B",
"Ir",
"Rh"
],
"chemical_system": "B-Ce-Ir-Rh",
"density": 13.034196706886714,
"density_atomic": 0.0725587628191019,
"volume": 82.69159736031818,
"volume_molar": 8.299673982884675,
"formula_full": "Ce1 B2 Ir2 Rh1",
"formula_reduced": "CeB2Ir2Rh",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 4.189050977777778,
"spacegroup": 65
},
{
"id": "jvasp-43162",
"created_at": "2022-09-04T14:36:55.906871Z",
"updated_at": "2022-09-04T14:36:55.906893Z",
"structure_string": "Li2 V1 Co3 O8\n1.0\n-2.878598 1.661960 4.700732\n-0.000000 3.323919 -4.700732\n-2.742975 -1.583658 -4.645363\nLi V Co O\n2 1 3 8\ndirect\n0.877129 0.122871 0.631385 Li\n0.122872 0.877128 0.368616 Li\n0.500001 0.500000 0.500000 V\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.500000 -0.000000 Co\n0.737915 0.715767 0.760061 O\n0.737915 0.262086 0.760061 O\n0.263940 0.736060 0.791818 O\n0.284233 0.262086 0.760061 O\n0.715768 0.737914 0.239940 O\n0.736061 0.263939 0.208183 O\n0.262086 0.737914 0.239940 O\n0.262086 0.284232 0.239940 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"Co",
"O"
],
"chemical_system": "Co-Li-O-V",
"density": 4.715286976865102,
"density_atomic": 0.10755574679322329,
"volume": 130.16505781801789,
"volume_molar": 5.599087858668873,
"formula_full": "Li2 V1 Co3 O8",
"formula_reduced": "Li2VCo3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.9523624928571426,
"spacegroup": 166
},
{
"id": "jvasp-102377",
"created_at": "2022-09-04T14:37:03.909670Z",
"updated_at": "2022-09-04T14:37:03.909695Z",
"structure_string": "K2 Nd1 Cu1 I6\n1.0\n7.247691 -0.000000 4.184456\n2.415897 6.833188 4.184456\n-0.000000 -0.000000 8.368913\nK Nd Cu I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Cu\n0.760212 0.239788 0.239788 I\n0.239788 0.239788 0.760212 I\n0.239788 0.760212 0.760212 I\n0.239788 0.760212 0.239788 I\n0.760212 0.239788 0.760212 I\n0.760212 0.760212 0.239788 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Nd",
"Cu",
"I"
],
"chemical_system": "Cu-I-K-Nd",
"density": 4.196375186084625,
"density_atomic": 0.02412725465711074,
"volume": 414.4690368679313,
"volume_molar": 24.959908806803124,
"formula_full": "K2 Nd1 Cu1 I6",
"formula_reduced": "K2NdCuI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-105587",
"created_at": "2022-09-04T14:36:48.861320Z",
"updated_at": "2022-09-04T14:36:48.861350Z",
"structure_string": "Li1 Ni3 O1 F5\n1.0\n4.416492 0.000002 2.565316\n-1.373024 4.621874 -2.646056\n0.002094 0.002154 5.148975\nLi Ni O F\n1 3 1 5\ndirect\n0.146978 0.430248 0.162890 Li\n0.367931 0.027182 0.329687 Ni\n0.656231 0.951126 0.623450 Ni\n0.833656 0.569698 0.878831 Ni\n0.545321 0.750376 0.258094 O\n0.061844 0.247253 0.445695 F\n0.255409 0.760636 0.929751 F\n0.760597 0.257134 0.057909 F\n0.437112 0.259062 0.753810 F\n0.934918 0.747275 0.559877 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Ni",
"O",
"F"
],
"chemical_system": "F-Li-Ni-O",
"density": 4.6454586542153695,
"density_atomic": 0.09515103909729132,
"volume": 105.09606720926153,
"volume_molar": 6.329033100565933,
"formula_full": "Li1 Ni3 O1 F5",
"formula_reduced": "LiNi3OF5",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 0.4786392112499998,
"spacegroup": 1
},
{
"id": "jvasp-103208",
"created_at": "2022-09-04T14:36:39.974452Z",
"updated_at": "2022-09-04T14:36:39.974473Z",
"structure_string": "Rb2 Na1 Ga1 Cl6\n1.0\n6.222458 -0.000000 3.592538\n2.074153 5.866590 3.592538\n-0.000000 -0.000000 7.185076\nRb Na Ga Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Ga\n0.765249 0.234751 0.234752 Cl\n0.234751 0.234751 0.765249 Cl\n0.234751 0.765249 0.765250 Cl\n0.234751 0.765249 0.234752 Cl\n0.765249 0.234751 0.765250 Cl\n0.765249 0.765249 0.234752 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"Ga",
"Cl"
],
"chemical_system": "Cl-Ga-Na-Rb",
"density": 3.0158595549251737,
"density_atomic": 0.03812597179325951,
"volume": 262.2883963253614,
"volume_molar": 15.795376423859933,
"formula_full": "Rb2 Na1 Ga1 Cl6",
"formula_reduced": "Rb2NaGaCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}