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=id&page=669",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=667",
"results": [
{
"id": "jvasp-111318",
"created_at": "2022-09-04T14:38:49.712214Z",
"updated_at": "2022-09-04T14:38:49.712233Z",
"structure_string": "Ce2 Al4 Ni2\n1.0\n5.727040 -0.130321 0.000000\n-4.198058 3.897728 0.000000\n-0.000000 -0.000000 6.869382\nCe Al Ni\n2 4 2\ndirect\n0.551209 0.448792 0.250000 Ce\n0.448791 0.551209 0.750000 Ce\n0.833522 0.166478 0.055406 Al\n0.166478 0.833523 0.944593 Al\n0.166478 0.833523 0.555406 Al\n0.833522 0.166478 0.444593 Al\n0.281620 0.718380 0.250000 Ni\n0.718380 0.281621 0.750000 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Al",
"Ni"
],
"chemical_system": "Al-Ce-Ni",
"density": 5.612108835411767,
"density_atomic": 0.05348194511260472,
"volume": 149.58319079749674,
"volume_molar": 11.260137878905777,
"formula_full": "Ce2 Al4 Ni2",
"formula_reduced": "CeAl2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4998383750000002,
"spacegroup": 63
},
{
"id": "jvasp-111319",
"created_at": "2022-09-04T14:38:48.915615Z",
"updated_at": "2022-09-04T14:38:48.915655Z",
"structure_string": "Sr1 Tl3\n1.0\n4.968375 -0.000000 0.000000\n0.000000 4.968375 0.000000\n-0.000000 -0.000000 4.968375\nSr Tl\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n-0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 -0.000000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Tl"
],
"chemical_system": "Sr-Tl",
"density": 9.488147629458881,
"density_atomic": 0.03261496282646141,
"volume": 122.64309547992772,
"volume_molar": 18.464349605556112,
"formula_full": "Sr1 Tl3",
"formula_reduced": "SrTl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0013424999999999,
"spacegroup": 221
},
{
"id": "jvasp-11132",
"created_at": "2022-09-04T14:36:51.867597Z",
"updated_at": "2022-09-04T14:36:51.867629Z",
"structure_string": "Nd4 S8\n1.0\n0.000000 8.052008 -0.012495\n4.043184 0.000000 0.000000\n0.000000 -0.005739 -8.136940\nNd S\n4 8\ndirect\n0.370720 0.287010 0.724508 Nd\n0.129280 0.787010 0.275492 Nd\n0.629280 0.712989 0.275492 Nd\n0.870720 0.212989 0.724507 Nd\n0.391459 0.840728 0.997655 S\n0.108541 0.340729 0.002344 S\n0.608541 0.159271 0.002344 S\n0.891459 0.659270 0.997655 S\n0.874869 0.240162 0.367086 S\n0.625131 0.740162 0.632913 S\n0.125131 0.759837 0.632913 S\n0.374869 0.259837 0.367087 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nd",
"S"
],
"chemical_system": "Nd-S",
"density": 5.2246735080083875,
"density_atomic": 0.04529934823461313,
"volume": 264.9044736328199,
"volume_molar": 13.294100234754582,
"formula_full": "Nd4 S8",
"formula_reduced": "NdS2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9663105,
"spacegroup": 14
},
{
"id": "jvasp-111320",
"created_at": "2022-09-04T14:38:49.795100Z",
"updated_at": "2022-09-04T14:38:49.795127Z",
"structure_string": "Nd1 Ni1 As1\n1.0\n4.121812 -0.000000 0.000000\n-2.060905 3.569594 0.000000\n-0.000000 -0.000000 4.045043\nNd Ni As\n1 1 1\ndirect\n0.666666 0.333333 0.500000 Nd\n0.333332 0.666666 -0.000000 Ni\n0.000000 0.000000 0.000000 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Nd",
"Ni",
"As"
],
"chemical_system": "As-Nd-Ni",
"density": 7.752473581364193,
"density_atomic": 0.050407030049223533,
"volume": 59.515507997008285,
"volume_molar": 11.94702555202965,
"formula_full": "Nd1 Ni1 As1",
"formula_reduced": "NdNiAs",
"formula_anonymous": "ABC",
"energy_above_hull": 1.124205216666667,
"spacegroup": 187
},
{
"id": "jvasp-111321",
"created_at": "2022-09-04T14:38:49.805475Z",
"updated_at": "2022-09-04T14:38:49.805499Z",
"structure_string": "Hf4 Se2\n1.0\n3.442205 -0.000000 0.000000\n-1.721102 2.981037 0.000000\n-0.000000 -0.000000 12.282490\nHf Se\n4 2\ndirect\n0.333334 0.666667 0.093042 Hf\n0.666668 0.333334 0.906958 Hf\n0.666668 0.333334 0.593042 Hf\n0.333334 0.666667 0.406958 Hf\n0.000000 0.000000 0.250000 Se\n0.000000 0.000000 0.750000 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"Se"
],
"chemical_system": "Hf-Se",
"density": 11.487229458536952,
"density_atomic": 0.04760589491602131,
"volume": 126.0348116674256,
"volume_molar": 12.64998960868879,
"formula_full": "Hf4 Se2",
"formula_reduced": "Hf2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 3.373676455555556,
"spacegroup": 194
},
{
"id": "jvasp-111322",
"created_at": "2022-09-04T14:38:49.957014Z",
"updated_at": "2022-09-04T14:38:49.957045Z",
"structure_string": "K1 Pa1 O3\n1.0\n4.374410 -0.000000 0.000000\n0.000000 4.374410 0.000000\n-0.000000 -0.000000 4.374410\nK Pa O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Pa\n0.500000 0.000000 -0.000000 O\n-0.000000 0.500000 -0.000000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Pa",
"O"
],
"chemical_system": "K-O-Pa",
"density": 6.311004863963449,
"density_atomic": 0.05973261766212939,
"volume": 83.70636003735713,
"volume_molar": 10.081829653044071,
"formula_full": "K1 Pa1 O3",
"formula_reduced": "KPaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.68168632,
"spacegroup": 221
},
{
"id": "jvasp-111323",
"created_at": "2022-09-04T14:38:49.861005Z",
"updated_at": "2022-09-04T14:38:49.861033Z",
"structure_string": "Li4 Al2\n1.0\n5.328274 0.000361 0.000000\n-3.348069 4.144989 0.000000\n-0.000000 -0.000000 4.457474\nLi Al\n4 2\ndirect\n0.241884 0.758116 0.250000 Li\n0.758115 0.241884 0.749999 Li\n0.589892 0.410108 0.250000 Li\n0.410107 0.589893 0.749999 Li\n0.923001 0.076998 0.250000 Al\n0.076998 0.923002 0.749999 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Li",
"Al"
],
"chemical_system": "Al-Li",
"density": 1.3784548563476429,
"density_atomic": 0.06094368816434184,
"volume": 98.4515407702319,
"volume_molar": 9.881483942620257,
"formula_full": "Li4 Al2",
"formula_reduced": "Li2Al",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8244709333333335,
"spacegroup": 63
},
{
"id": "jvasp-111324",
"created_at": "2022-09-04T14:38:46.667259Z",
"updated_at": "2022-09-04T14:38:46.667273Z",
"structure_string": "Au2 Cl8\n1.0\n6.162691 -0.579908 -3.996457\n-2.129739 5.811993 -3.996457\n0.447000 0.579908 7.331481\nAu Cl\n2 8\ndirect\n0.000000 0.000000 0.000000 Au\n0.750000 0.250000 0.499999 Au\n0.488001 0.295068 0.192932 Cl\n0.102135 0.295068 0.807067 Cl\n0.045068 0.352135 0.307067 Cl\n0.647865 -0.045068 0.692933 Cl\n0.261999 -0.045068 0.307067 Cl\n0.045068 0.738001 0.692932 Cl\n0.704932 -0.102135 0.192933 Cl\n0.704932 0.511999 0.807066 Cl\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Au",
"Cl"
],
"chemical_system": "Au-Cl",
"density": 3.9591790578146027,
"density_atomic": 0.03518925895876733,
"volume": 284.177623965239,
"volume_molar": 17.113576523610185,
"formula_full": "Au2 Cl8",
"formula_reduced": "AuCl4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.1747307679999999,
"spacegroup": 141
},
{
"id": "jvasp-111325",
"created_at": "2022-09-04T14:38:52.007345Z",
"updated_at": "2022-09-04T14:38:52.007373Z",
"structure_string": "Zr1 Be1 B1\n1.0\n3.405623 -0.000000 0.000000\n-1.702811 2.949357 0.000000\n0.000000 0.000000 3.500003\nZr Be B\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.333334 0.666667 0.500000 Be\n0.666666 0.333334 0.500000 B\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Be",
"B"
],
"chemical_system": "B-Be-Zr",
"density": 5.245227247485535,
"density_atomic": 0.08533534010830067,
"volume": 35.1554232536326,
"volume_molar": 7.057030243691757,
"formula_full": "Zr1 Be1 B1",
"formula_reduced": "ZrBeB",
"formula_anonymous": "ABC",
"energy_above_hull": 2.927171061111112,
"spacegroup": 187
},
{
"id": "jvasp-111326",
"created_at": "2022-09-04T14:38:48.056540Z",
"updated_at": "2022-09-04T14:38:48.056567Z",
"structure_string": "Zr2 As3 Se1\n1.0\n3.833027 -0.000000 0.000000\n0.000000 3.833027 0.000000\n-0.000000 -0.000000 8.117909\nZr As Se\n2 3 1\ndirect\n0.500000 0.500000 0.735204 Zr\n0.000000 0.000000 0.266689 Zr\n0.500000 0.000000 0.999303 As\n-0.000000 0.500000 0.999303 As\n0.500000 0.500000 0.378122 As\n0.000000 0.000000 0.621383 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"As",
"Se"
],
"chemical_system": "As-Se-Zr",
"density": 6.768802142838064,
"density_atomic": 0.05030640870264296,
"volume": 119.26909820705959,
"volume_molar": 11.970921628686273,
"formula_full": "Zr2 As3 Se1",
"formula_reduced": "Zr2As3Se",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.9731312694444445,
"spacegroup": 99
},
{
"id": "jvasp-111329",
"created_at": "2022-09-04T14:38:49.865952Z",
"updated_at": "2022-09-04T14:38:49.865974Z",
"structure_string": "Y2 Mn2 Co2\n1.0\n4.451848 -0.014945 2.429962\n-2.924483 4.138837 0.203269\n-0.101123 -0.014945 5.070842\nY Mn Co\n2 2 2\ndirect\n0.500003 0.747299 0.752701 Y\n0.000001 0.002704 0.997296 Y\n0.250002 0.875001 0.374999 Mn\n0.750002 0.375002 0.374999 Mn\n0.750003 0.375002 0.874998 Co\n0.250001 0.375001 0.374999 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Mn",
"Co"
],
"chemical_system": "Co-Mn-Y",
"density": 7.137808287622557,
"density_atomic": 0.0635942939719851,
"volume": 94.34808730863735,
"volume_molar": 9.469624370156396,
"formula_full": "Y2 Mn2 Co2",
"formula_reduced": "YMnCo",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0475711971264365,
"spacegroup": 74
},
{
"id": "jvasp-11133",
"created_at": "2022-09-04T14:37:06.014879Z",
"updated_at": "2022-09-04T14:37:06.014898Z",
"structure_string": "Cu1 B1 C4 N4\n1.0\n5.409524 -0.000000 0.000000\n0.000000 5.409524 -0.000000\n0.000000 -0.000000 5.409524\nCu B C N\n1 1 4 4\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 B\n0.830918 0.169081 0.169081 C\n0.830918 0.830918 0.830918 C\n0.169081 0.169081 0.830918 C\n0.169081 0.830918 0.169081 C\n0.707055 0.707055 0.707055 N\n0.707055 0.292944 0.292944 N\n0.292944 0.292944 0.707055 N\n0.292944 0.707055 0.292944 N\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Cu",
"B",
"C",
"N"
],
"chemical_system": "B-C-Cu-N",
"density": 1.8716797494584112,
"density_atomic": 0.06317174072013525,
"volume": 158.29862983042065,
"volume_molar": 9.532966309539281,
"formula_full": "Cu1 B1 C4 N4",
"formula_reduced": "CuB(CN)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 5.864499603333333,
"spacegroup": 215
}
]
}