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=density_atomic&page=363",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=361",
"results": [
{
"id": "jvasp-15964",
"created_at": "2022-09-04T14:38:31.662312Z",
"updated_at": "2022-09-04T14:38:31.662336Z",
"structure_string": "Ho3 In1 C1\n1.0\n5.518183 0.000000 0.000000\n0.000000 5.518183 0.000000\n-0.000000 -0.000000 5.518183\nHo In C\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Ho\n0.500000 0.500000 0.000000 Ho\n0.000000 0.500000 0.500000 Ho\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ho",
"In",
"C"
],
"chemical_system": "C-Ho-In",
"density": 6.143071103736276,
"density_atomic": 0.029756490406185762,
"volume": 168.030568516259,
"volume_molar": 20.238074711754724,
"formula_full": "Ho3 In1 C1",
"formula_reduced": "Ho3InC",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.388869334,
"spacegroup": 221
},
{
"id": "jvasp-118884",
"created_at": "2022-09-04T14:38:47.782014Z",
"updated_at": "2022-09-04T14:38:47.782029Z",
"structure_string": "As1 I2\n1.0\n5.626181 -0.000000 -0.000000\n-2.813091 4.872416 -0.000000\n-0.000000 -0.000000 3.677734\nAs I\n1 2\ndirect\n0.000000 0.000000 0.000000 As\n0.333334 0.666668 0.000000 I\n0.666667 0.333334 0.000000 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"As",
"I"
],
"chemical_system": "As-I",
"density": 5.414405465837737,
"density_atomic": 0.02975657070826726,
"volume": 100.8180690379927,
"volume_molar": 20.23802009660633,
"formula_full": "As1 I2",
"formula_reduced": "AsI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6786981000000001,
"spacegroup": 191
},
{
"id": "jvasp-65321",
"created_at": "2022-09-04T14:36:12.089895Z",
"updated_at": "2022-09-04T14:36:12.089921Z",
"structure_string": "Ba1 Na2 Zr1\n1.0\n3.341010 0.000000 0.000000\n0.000000 5.281249 0.000000\n0.000000 0.000000 7.617705\nBa Na Zr\n1 2 1\ndirect\n0.500000 0.500000 0.728419 Ba\n0.000000 0.000000 0.020821 Na\n0.500000 0.500000 0.262207 Na\n0.000000 0.000000 0.488553 Zr\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Zr"
],
"chemical_system": "Ba-Na-Zr",
"density": 3.3915731588962217,
"density_atomic": 0.029759211597955307,
"volume": 134.41216299812297,
"volume_molar": 20.236224135769003,
"formula_full": "Ba1 Na2 Zr1",
"formula_reduced": "BaNa2Zr",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7963771175000002,
"spacegroup": 25
},
{
"id": "jvasp-42095",
"created_at": "2022-09-04T14:37:48.710073Z",
"updated_at": "2022-09-04T14:37:48.710087Z",
"structure_string": "Pb2 Cl4\n1.0\n6.739906 -0.000000 0.000000\n-0.000000 6.739906 0.000000\n0.000000 0.000000 4.438332\nPb Cl\n2 4\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 Pb\n0.302466 0.302466 0.000000 Cl\n0.697535 0.697535 0.000000 Cl\n0.197534 0.802466 0.500000 Cl\n0.802466 0.197534 0.500000 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pb",
"Cl"
],
"chemical_system": "Cl-Pb",
"density": 4.581017882151085,
"density_atomic": 0.0297593736056661,
"volume": 201.6171469031733,
"volume_molar": 20.236113971341794,
"formula_full": "Pb2 Cl4",
"formula_reduced": "PbCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0238399999999999,
"spacegroup": 136
},
{
"id": "jvasp-69295",
"created_at": "2022-09-04T14:36:13.111607Z",
"updated_at": "2022-09-04T14:36:13.111632Z",
"structure_string": "Ba1 Zn1 Bi2\n1.0\n4.277388 0.000000 0.000000\n0.000000 4.277521 0.000000\n0.000000 0.000000 7.346220\nBa Zn Bi\n1 1 2\ndirect\n0.500000 0.500000 0.735119 Ba\n0.000000 0.000000 0.466562 Zn\n0.000000 0.000000 0.060519 Bi\n0.500000 0.500000 0.237801 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Bi"
],
"chemical_system": "Ba-Bi-Zn",
"density": 7.668207859263005,
"density_atomic": 0.029759474913599412,
"volume": 134.41097370209613,
"volume_molar": 20.23604508306703,
"formula_full": "Ba1 Zn1 Bi2",
"formula_reduced": "BaZnBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.165718575,
"spacegroup": 99
},
{
"id": "jvasp-4026",
"created_at": "2022-09-04T14:37:01.203571Z",
"updated_at": "2022-09-04T14:37:01.203593Z",
"structure_string": "Bi2 Te2 Cl2\n1.0\n2.146891 -3.718524 0.000000\n2.146891 3.718524 0.000000\n0.000000 0.000000 12.627318\nBi Te Cl\n2 2 2\ndirect\n0.333333 0.666667 0.137312 Bi\n0.666667 0.333333 0.637312 Bi\n0.666667 0.333333 0.277228 Te\n0.333333 0.666667 0.777228 Te\n0.000000 0.000000 0.003559 Cl\n0.000000 0.000000 0.503559 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Bi",
"Te",
"Cl"
],
"chemical_system": "Bi-Cl-Te",
"density": 6.128290257144929,
"density_atomic": 0.02975976879448223,
"volume": 201.61446956914742,
"volume_molar": 20.235845249969042,
"formula_full": "Bi2 Te2 Cl2",
"formula_reduced": "BiTeCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3639953780555555,
"spacegroup": 186
},
{
"id": "jvasp-69177",
"created_at": "2022-09-04T14:36:14.157256Z",
"updated_at": "2022-09-04T14:36:14.157281Z",
"structure_string": "Ba1 Zn1 Bi2\n1.0\n4.277236 0.000000 -0.000000\n0.000000 4.277236 0.000000\n-0.000000 0.000000 7.346762\nBa Zn Bi\n1 1 2\ndirect\n0.500000 0.500000 0.735116 Ba\n0.000000 0.000000 0.466549 Zn\n0.000000 0.000000 0.060509 Bi\n0.500000 0.500000 0.237826 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Bi"
],
"chemical_system": "Ba-Bi-Zn",
"density": 7.668425556745501,
"density_atomic": 0.02976031977368771,
"volume": 134.4071579343902,
"volume_molar": 20.235470605811216,
"formula_full": "Ba1 Zn1 Bi2",
"formula_reduced": "BaZnBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.165716075,
"spacegroup": 99
},
{
"id": "jvasp-8821",
"created_at": "2022-09-04T14:36:46.068598Z",
"updated_at": "2022-09-04T14:36:46.068627Z",
"structure_string": "Bi1 Te3\n1.0\n8.727156 -0.333078 -0.198178\n7.826107 3.876370 -0.198178\n7.826107 1.675209 3.501313\nBi Te\n1 3\ndirect\n0.392717 0.392717 0.392715 Bi\n0.223368 0.223368 0.223367 Te\n0.977910 0.977909 0.977906 Te\n0.804509 0.804509 0.804506 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"Te"
],
"chemical_system": "Bi-Te",
"density": 7.3114007016544384,
"density_atomic": 0.029761231830822188,
"volume": 134.40303891781133,
"volume_molar": 20.23485047337045,
"formula_full": "Bi1 Te3",
"formula_reduced": "BiTe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9186444,
"spacegroup": 160
},
{
"id": "jvasp-5257",
"created_at": "2022-09-04T14:37:39.983340Z",
"updated_at": "2022-09-04T14:37:39.983368Z",
"structure_string": "Ga2 Se2 Br14\n1.0\n0.000000 6.553683 -0.139394\n6.507554 0.000000 0.000000\n0.000000 -3.187617 -14.112550\nGa Se Br\n2 2 14\ndirect\n0.333988 -0.004972 0.499093 Ga\n0.333988 0.004972 0.999093 Ga\n0.052081 0.581140 0.337534 Se\n0.052081 0.418859 0.837534 Se\n0.778305 0.628602 0.870560 Br\n0.778306 0.371398 0.370560 Br\n0.366667 0.353435 0.512125 Br\n0.366667 0.646565 0.012125 Br\n0.559614 0.840182 0.628444 Br\n0.559614 0.159817 0.128444 Br\n0.423529 0.125100 0.857239 Br\n0.850275 0.812126 0.226863 Br\n-0.007188 0.877531 0.498920 Br\n-0.007188 0.122469 -0.001080 Br\n0.195474 0.371928 0.232350 Br\n0.195474 0.628071 0.732350 Br\n0.423530 0.874899 0.357239 Br\n0.850275 0.187874 0.726863 Br\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"Se",
"Br"
],
"chemical_system": "Br-Ga-Se",
"density": 3.8880242058304626,
"density_atomic": 0.029763388066711884,
"volume": 604.7698588498952,
"volume_molar": 20.23338454110778,
"formula_full": "Ga2 Se2 Br14",
"formula_reduced": "GaSeBr7",
"formula_anonymous": "ABC7",
"energy_above_hull": 0.0,
"spacegroup": 7
},
{
"id": "jvasp-35067",
"created_at": "2022-09-04T14:37:38.737722Z",
"updated_at": "2022-09-04T14:37:38.737749Z",
"structure_string": "K2 Mg2 Bi2\n1.0\n4.899594 0.000000 0.000000\n0.000000 4.899594 0.000000\n-0.000000 0.000000 8.397315\nK Mg Bi\n2 2 2\ndirect\n0.500000 0.000000 0.351160 K\n0.000000 0.500000 0.648839 K\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.790787 Bi\n0.000000 0.500000 0.209212 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Mg",
"Bi"
],
"chemical_system": "Bi-K-Mg",
"density": 4.487449508497067,
"density_atomic": 0.029763953499678315,
"volume": 201.58612329725779,
"volume_molar": 20.233000162646693,
"formula_full": "K2 Mg2 Bi2",
"formula_reduced": "KMgBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-38662",
"created_at": "2022-09-04T14:37:53.571628Z",
"updated_at": "2022-09-04T14:37:53.571646Z",
"structure_string": "Na1 Nd3\n1.0\n5.122042 -0.000000 0.000000\n-0.000000 5.122042 -0.000000\n0.000000 -0.000000 5.122042\nNa Nd\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Nd\n0.500000 0.000000 0.500000 Nd\n0.000000 0.500000 0.500000 Nd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Nd"
],
"chemical_system": "Na-Nd",
"density": 5.631365922659927,
"density_atomic": 0.029766692798561672,
"volume": 134.37838147048973,
"volume_molar": 20.231138207906625,
"formula_full": "Na1 Nd3",
"formula_reduced": "NaNd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.1235685000000002,
"spacegroup": 221
},
{
"id": "jvasp-56604",
"created_at": "2022-09-04T14:38:35.165359Z",
"updated_at": "2022-09-04T14:38:35.165387Z",
"structure_string": "Ba4 Au4\n1.0\n5.086259 -0.000000 0.000000\n-0.000000 6.387087 0.000000\n0.000000 0.000000 8.270109\nBa Au\n4 4\ndirect\n0.250000 0.855448 0.686733 Ba\n0.250000 0.644552 0.186733 Ba\n0.750000 0.144552 0.313267 Ba\n0.750000 0.355448 0.813267 Ba\n0.250000 0.351676 0.539921 Au\n0.750000 0.851676 0.960080 Au\n0.250000 0.148325 0.039921 Au\n0.750000 0.648325 0.460079 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ba",
"Au"
],
"chemical_system": "Au-Ba",
"density": 8.264652047615506,
"density_atomic": 0.02977676066533159,
"volume": 268.6658931746803,
"volume_molar": 20.224297826363102,
"formula_full": "Ba4 Au4",
"formula_reduced": "BaAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 62
}
]
}