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=4348",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4346",
"results": [
{
"id": "jvasp-20193",
"created_at": "2022-09-04T14:37:32.798188Z",
"updated_at": "2022-09-04T14:37:32.798220Z",
"structure_string": "Tm16 O24\n1.0\n8.523550 -0.000000 -3.013531\n-4.261775 7.381610 -3.013531\n0.000000 0.000000 9.040591\nTm O\n16 24\ndirect\n0.250000 0.717068 0.467067 Tm\n0.500000 0.500000 0.500000 Tm\n-0.000000 -0.000000 0.500000 Tm\n0.500000 0.000000 0.000000 Tm\n-0.000000 0.500000 -0.000000 Tm\n0.250000 0.217068 0.967067 Tm\n0.532932 0.750000 0.282932 Tm\n0.282932 0.532932 0.750000 Tm\n0.967067 0.250000 0.217068 Tm\n0.750000 0.282932 0.532932 Tm\n0.750000 0.782932 0.032932 Tm\n0.717067 0.467068 0.250000 Tm\n0.467067 0.250000 0.717068 Tm\n0.782932 0.032932 0.750000 Tm\n0.217067 0.967068 0.250000 Tm\n0.032932 0.750000 0.782932 Tm\n0.228764 0.456352 0.467991 O\n0.032009 0.488361 0.760773 O\n0.227588 0.271236 0.739227 O\n0.272412 0.011639 0.043648 O\n0.532009 0.771236 0.543648 O\n0.271235 0.739227 0.227588 O\n0.988361 0.956352 0.727588 O\n0.260773 0.772412 0.728764 O\n0.511639 0.239227 0.967991 O\n0.956352 0.727588 0.988361 O\n0.728764 0.260773 0.772412 O\n0.239226 0.967991 0.511639 O\n0.543647 0.532009 0.771236 O\n0.760773 0.032009 0.488361 O\n0.771235 0.543648 0.532009 O\n0.772412 0.728764 0.260773 O\n0.967991 0.511639 0.239227 O\n0.467991 0.228764 0.456352 O\n0.011639 0.043648 0.272412 O\n0.739227 0.227588 0.271236 O\n0.488361 0.760773 0.032009 O\n0.043648 0.272412 0.011639 O\n0.727587 0.988361 0.956352 O\n0.456352 0.467991 0.228764 O\n",
"nsites": 40,
"nelements": 2,
"elements": [
"Tm",
"O"
],
"chemical_system": "O-Tm",
"density": 9.011723626799622,
"density_atomic": 0.07032205608969173,
"volume": 568.8115823715721,
"volume_molar": 8.563658537399855,
"formula_full": "Tm16 O24",
"formula_reduced": "Tm2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3295397999999998,
"spacegroup": 206
},
{
"id": "jvasp-34569",
"created_at": "2022-09-04T14:37:10.527560Z",
"updated_at": "2022-09-04T14:37:10.527586Z",
"structure_string": "Tm6 O9\n1.0\n3.420287 -0.000000 0.000000\n-1.710143 6.787604 -1.226649\n0.000000 0.006237 8.475327\nTm O\n6 9\ndirect\n0.635163 0.270323 0.486721 Tm\n0.691046 0.382090 0.137325 Tm\n0.308956 0.617910 0.862675 Tm\n0.032603 0.065206 0.814056 Tm\n0.364839 0.729677 0.513280 Tm\n0.967399 0.934794 0.185944 Tm\n0.127523 0.255046 0.281580 O\n0.207199 0.414399 0.623037 O\n0.529735 0.059469 0.656593 O\n0.872479 0.744954 0.718420 O\n0.825470 0.650936 0.031411 O\n0.500000 0.000000 -0.000000 O\n0.174532 0.349063 0.968589 O\n0.792802 0.585601 0.376962 O\n0.470266 0.940530 0.343407 O\n",
"nsites": 15,
"nelements": 2,
"elements": [
"Tm",
"O"
],
"chemical_system": "O-Tm",
"density": 9.768194522087166,
"density_atomic": 0.07622509871856582,
"volume": 196.78557656425198,
"volume_molar": 7.9004696107178844,
"formula_full": "Tm6 O9",
"formula_reduced": "Tm2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3358438,
"spacegroup": 12
},
{
"id": "jvasp-55357",
"created_at": "2022-09-04T14:37:03.056356Z",
"updated_at": "2022-09-04T14:37:03.056388Z",
"structure_string": "Tm4 V4 O14\n1.0\n6.100012 -0.000000 3.521844\n2.033337 5.751146 3.521844\n-0.000000 -0.000000 7.043686\nTm V O\n4 4 14\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.000000 -0.000000 Tm\n0.000000 0.500000 -0.000000 Tm\n0.000000 0.000000 0.500000 Tm\n0.500000 0.500000 0.500000 V\n0.500000 0.500000 -0.000001 V\n0.000000 0.500000 0.500000 V\n0.500000 0.000000 0.500000 V\n0.168879 0.168879 0.581121 O\n0.168879 0.581121 0.168879 O\n0.581121 0.168879 0.581121 O\n0.875000 0.875001 0.874999 O\n0.418879 0.418879 0.831121 O\n0.831121 0.418879 0.418879 O\n0.418879 0.831121 0.418879 O\n0.831121 0.418879 0.831120 O\n0.418879 0.831121 0.831120 O\n0.581121 0.581121 0.168879 O\n0.831121 0.831121 0.418878 O\n0.125000 0.125000 0.125000 O\n0.581121 0.168879 0.168879 O\n0.168879 0.581121 0.581120 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tm",
"V",
"O"
],
"chemical_system": "O-Tm-V",
"density": 7.415393077816296,
"density_atomic": 0.08903025376883437,
"volume": 247.1070121525504,
"volume_molar": 6.764150954389495,
"formula_full": "Tm4 V4 O14",
"formula_reduced": "Tm2V2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.8210955818181818,
"spacegroup": 227
},
{
"id": "jvasp-46372",
"created_at": "2022-09-04T14:38:11.074889Z",
"updated_at": "2022-09-04T14:38:11.074916Z",
"structure_string": "Tm6 W1 O12\n1.0\n4.829362 2.788234 3.063364\n-4.829362 2.788234 3.063364\n0.000000 -5.576468 3.063364\nTm W O\n6 1 12\ndirect\n0.388664 0.856219 0.682486 Tm\n0.317513 0.611334 0.143779 Tm\n0.143779 0.317513 0.611335 Tm\n0.856219 0.682485 0.388665 Tm\n0.682485 0.388664 0.856221 Tm\n0.611334 0.143779 0.317514 Tm\n0.000000 0.000000 0.000000 W\n0.822710 0.411064 0.570446 O\n0.429553 0.177288 0.588935 O\n0.920828 0.700292 0.035197 O\n0.588935 0.429553 0.177289 O\n0.411064 0.570445 0.822711 O\n0.177288 0.588935 0.429554 O\n0.570445 0.822710 0.411065 O\n0.700292 0.035197 0.920829 O\n0.299707 0.964802 0.079171 O\n0.035197 0.920828 0.700293 O\n0.079170 0.299707 0.964802 O\n0.964802 0.079170 0.299707 O\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Tm",
"W",
"O"
],
"chemical_system": "O-Tm-W",
"density": 9.322222290488344,
"density_atomic": 0.07676880264283903,
"volume": 247.49637021689716,
"volume_molar": 7.844515679132771,
"formula_full": "Tm6 W1 O12",
"formula_reduced": "Tm6WO12",
"formula_anonymous": "AB6C12",
"energy_above_hull": 2.7880688157894733,
"spacegroup": 148
},
{
"id": "jvasp-50882",
"created_at": "2022-09-04T14:36:49.511279Z",
"updated_at": "2022-09-04T14:36:49.511305Z",
"structure_string": "Y4 Tm4 O12\n1.0\n5.612853 0.000000 0.000000\n0.000000 5.889227 0.000000\n0.000000 0.000000 8.307184\nY Tm O\n4 4 12\ndirect\n0.020459 0.943390 0.750000 Y\n0.479541 0.443390 0.750000 Y\n0.520459 0.556610 0.250000 Y\n0.979540 0.056610 0.250000 Y\n0.000000 0.500000 0.000000 Tm\n0.000000 0.500000 0.500000 Tm\n0.500000 0.000000 0.000000 Tm\n0.500000 0.000000 0.500000 Tm\n0.814059 0.810245 0.078666 O\n0.685941 0.310245 0.078666 O\n0.685941 0.310245 0.421334 O\n0.647577 0.076940 0.750000 O\n0.352423 0.923061 0.250000 O\n0.185941 0.189756 0.578666 O\n0.314059 0.689756 0.921334 O\n0.185941 0.189756 0.921334 O\n0.814059 0.810245 0.421334 O\n0.147577 0.423060 0.250000 O\n0.314059 0.689756 0.578666 O\n0.852423 0.576940 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Y",
"Tm",
"O"
],
"chemical_system": "O-Tm-Y",
"density": 7.397842999231236,
"density_atomic": 0.07283400689819988,
"volume": 274.5970028527197,
"volume_molar": 8.268309017265997,
"formula_full": "Y4 Tm4 O12",
"formula_reduced": "YTmO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.6832600399999995,
"spacegroup": 62
},
{
"id": "jvasp-50856",
"created_at": "2022-09-04T14:37:17.350619Z",
"updated_at": "2022-09-04T14:37:17.350639Z",
"structure_string": "Tm4 Zr4 O14\n1.0\n-5.221053 5.221053 -0.000000\n5.221053 0.000000 5.221053\n5.221053 5.221053 -0.000000\nTm Zr O\n4 4 14\ndirect\n0.625000 0.750000 0.125000 Tm\n0.125000 0.250000 0.125000 Tm\n0.125000 0.750000 0.125000 Tm\n0.125000 0.250000 0.625000 Tm\n0.625000 0.250000 0.125000 Zr\n0.625000 0.250000 0.625000 Zr\n0.625000 0.750000 0.625000 Zr\n0.125000 0.750000 0.625000 Zr\n0.968379 0.936758 0.531620 O\n0.531620 0.063242 0.968379 O\n0.968379 0.500000 0.968379 O\n0.250000 0.500000 0.250000 O\n0.531620 0.500000 0.531620 O\n0.281621 0.000000 0.718379 O\n0.281621 0.000000 0.281621 O\n0.718379 0.000000 0.718379 O\n0.000000 0.000000 0.000000 O\n0.531620 0.500000 0.968379 O\n0.718379 0.436758 0.281621 O\n0.718379 0.000000 0.281621 O\n0.968379 0.500000 0.531620 O\n0.281621 0.563241 0.718379 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tm",
"Zr",
"O"
],
"chemical_system": "O-Tm-Zr",
"density": 7.377451565493229,
"density_atomic": 0.07728912304133481,
"volume": 284.64548612143307,
"volume_molar": 7.791705382372257,
"formula_full": "Tm4 Zr4 O14",
"formula_reduced": "Tm2Zr2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.761625636363636,
"spacegroup": 227
},
{
"id": "jvasp-41466",
"created_at": "2022-09-04T14:37:49.715567Z",
"updated_at": "2022-09-04T14:37:49.715596Z",
"structure_string": "U2 O4\n1.0\n5.128479 -0.000000 0.000000\n-0.000000 5.128479 0.000000\n0.000000 0.000000 3.600064\nU O\n2 4\ndirect\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.499999 U\n0.308173 0.308173 0.000000 O\n0.691827 0.691827 0.000000 O\n0.191827 0.808174 0.499999 O\n0.808174 0.191827 0.499999 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 9.471091709833876,
"density_atomic": 0.06336710493215587,
"volume": 94.6863519553862,
"volume_molar": 9.503575658770616,
"formula_full": "U2 O4",
"formula_reduced": "UO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.065644333333333,
"spacegroup": 136
},
{
"id": "jvasp-12393",
"created_at": "2022-09-04T14:38:13.408847Z",
"updated_at": "2022-09-04T14:38:13.408865Z",
"structure_string": "U4 O12\n1.0\n5.205781 0.000000 0.000000\n0.000000 5.518071 0.000000\n0.000000 0.000000 7.425292\nU O\n4 12\ndirect\n0.284276 0.375275 0.192231 U\n0.784276 0.124725 0.807769 U\n0.715724 0.875274 0.307769 U\n0.215724 0.624725 0.692231 U\n0.915527 0.865061 0.571178 O\n0.415527 0.634939 0.428822 O\n0.084473 0.365061 0.928822 O\n0.584473 0.134939 0.071178 O\n0.926821 0.597934 0.253004 O\n0.426821 0.902066 0.746995 O\n0.073179 0.097934 0.246995 O\n0.573179 0.402066 0.753004 O\n0.037561 0.354596 0.591397 O\n0.537561 0.145404 0.408603 O\n0.962439 0.854596 0.908603 O\n0.462439 0.645404 0.091397 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 8.906961430331396,
"density_atomic": 0.07501243570357101,
"volume": 213.29796652954585,
"volume_molar": 8.028189864141837,
"formula_full": "U4 O12",
"formula_reduced": "UO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4908716250000005,
"spacegroup": 19
},
{
"id": "jvasp-8160",
"created_at": "2022-09-04T14:36:44.368218Z",
"updated_at": "2022-09-04T14:36:44.368243Z",
"structure_string": "U1 O3\n1.0\n1.900329 -3.291465 -0.000000\n1.900329 3.291465 0.000000\n-0.000000 0.000000 4.150577\nU O\n1 3\ndirect\n0.000000 0.000000 0.000000 U\n0.333333 0.666668 0.116279 O\n0.000000 0.000000 0.500000 O\n0.666668 0.333333 0.883722 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 9.14744458840864,
"density_atomic": 0.07703773103847959,
"volume": 51.92260916929185,
"volume_molar": 7.817131526098555,
"formula_full": "U1 O3",
"formula_reduced": "UO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.493919125000001,
"spacegroup": 164
},
{
"id": "jvasp-20297",
"created_at": "2022-09-04T14:38:31.504117Z",
"updated_at": "2022-09-04T14:38:31.504127Z",
"structure_string": "U3 O8\n1.0\n3.414414 -5.913939 -0.000000\n3.414414 5.913939 0.000000\n-0.000000 -0.000000 4.162483\nU O\n3 8\ndirect\n0.647356 -0.000000 0.000000 U\n0.352643 0.352643 0.000000 U\n-0.000000 0.647356 0.000000 U\n0.639188 -0.000000 0.500000 O\n0.360811 0.360811 0.500000 O\n-0.000000 0.639188 0.500000 O\n0.333332 0.666666 0.000000 O\n0.666666 0.333332 0.000000 O\n-0.000000 0.253914 0.000000 O\n0.746085 0.746085 0.000000 O\n0.253914 -0.000000 0.000000 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 8.318173180503626,
"density_atomic": 0.0654360683811336,
"volume": 168.10300912228246,
"volume_molar": 9.203090755581355,
"formula_full": "U3 O8",
"formula_reduced": "U3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.7820450909090906,
"spacegroup": 189
},
{
"id": "jvasp-1222",
"created_at": "2022-09-04T14:35:58.196565Z",
"updated_at": "2022-09-04T14:35:58.196584Z",
"structure_string": "U5 O10\n1.0\n3.321518 0.000915 1.914723\n1.106751 3.130364 1.916949\n0.012862 -0.004552 19.169494\nU O\n5 10\ndirect\n0.682746 0.783363 0.150105 U\n0.682838 0.783310 0.350108 U\n0.682822 0.783324 0.550106 U\n0.682804 0.783326 0.750109 U\n0.682788 0.783344 0.950105 U\n0.932774 0.033359 0.000102 O\n0.432748 0.533362 0.100105 O\n0.932836 0.033315 0.400108 O\n0.932738 0.033355 0.200110 O\n0.432840 0.533313 0.300107 O\n0.432843 0.533321 0.500103 O\n0.932787 0.033326 0.800112 O\n0.932806 0.033332 0.600106 O\n0.432811 0.533319 0.700110 O\n0.432817 0.533340 0.900101 O\n",
"nsites": 15,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 11.252615005669076,
"density_atomic": 0.0752865305997434,
"volume": 199.23882639441382,
"volume_molar": 7.998961716029089,
"formula_full": "U5 O10",
"formula_reduced": "UO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0081176666666667,
"spacegroup": 225
},
{
"id": "jvasp-14929",
"created_at": "2022-09-04T14:35:47.357647Z",
"updated_at": "2022-09-04T14:35:47.357675Z",
"structure_string": "U1 O1\n1.0\n2.977354 -0.000000 1.718976\n0.992452 2.807077 1.718976\n0.000000 0.000000 3.437953\nU O\n1 1\ndirect\n0.000000 0.000000 0.000000 U\n0.499999 0.500001 0.500001 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 14.68069044171674,
"density_atomic": 0.06960577293495919,
"volume": 28.733248919868096,
"volume_molar": 8.651783474378183,
"formula_full": "U1 O1",
"formula_reduced": "UO",
"formula_anonymous": "AB",
"energy_above_hull": 1.55613475,
"spacegroup": 225
}
]
}