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=3855",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=3853",
"results": [
{
"id": "jvasp-59701",
"created_at": "2022-09-04T14:38:33.512585Z",
"updated_at": "2022-09-04T14:38:33.512601Z",
"structure_string": "Si4 P8\n1.0\n5.783281 -0.000000 -0.000000\n0.000000 5.783281 0.000000\n0.000000 0.000000 5.783281\nSi P\n4 8\ndirect\n0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.500000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.608707 0.608707 0.608707 P\n0.891293 0.391293 0.108707 P\n0.108707 0.891293 0.391293 P\n0.391293 0.108707 0.891293 P\n0.608707 0.891293 0.108707 P\n0.891293 0.108707 0.608707 P\n0.108707 0.608707 0.891293 P\n0.391293 0.391293 0.391293 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"P"
],
"chemical_system": "P-Si",
"density": 3.0916337719565865,
"density_atomic": 0.06203808202485692,
"volume": 193.42957758094352,
"volume_molar": 9.707167861164852,
"formula_full": "Si4 P8",
"formula_reduced": "SiP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.6517832,
"spacegroup": 205
},
{
"id": "jvasp-20326",
"created_at": "2022-09-04T14:38:32.980581Z",
"updated_at": "2022-09-04T14:38:32.980611Z",
"structure_string": "Na1 F1\n1.0\n2.836480 0.000000 1.637643\n0.945493 2.674259 1.637643\n0.000000 0.000000 3.275285\nNa F\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.499999 0.500000 0.500000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"F"
],
"chemical_system": "F-Na",
"density": 2.806362587376898,
"density_atomic": 0.08050033870215188,
"volume": 24.84461596366597,
"volume_molar": 7.480888723066976,
"formula_full": "Na1 F1",
"formula_reduced": "NaF",
"formula_anonymous": "AB",
"energy_above_hull": 0.01069,
"spacegroup": 225
},
{
"id": "jvasp-107981",
"created_at": "2022-09-04T14:38:45.958302Z",
"updated_at": "2022-09-04T14:38:45.958325Z",
"structure_string": "Sc2 I6\n1.0\n10.376269 -0.000000 0.000000\n-5.188134 8.986113 0.000000\n-0.000000 -0.000000 3.807794\nSc I\n2 6\ndirect\n0.333334 0.666666 0.749999 Sc\n0.666667 0.333333 0.250000 Sc\n0.210256 0.420511 0.250000 I\n0.579489 0.789744 0.250000 I\n0.210256 0.789744 0.250000 I\n0.789744 0.579489 0.749999 I\n0.420511 0.210256 0.749999 I\n0.789744 0.210256 0.749999 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sc",
"I"
],
"chemical_system": "I-Sc",
"density": 3.9816666906283067,
"density_atomic": 0.02253219204615678,
"volume": 355.04756854602283,
"volume_molar": 26.726830428498726,
"formula_full": "Sc2 I6",
"formula_reduced": "ScI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.11475351875,
"spacegroup": 194
},
{
"id": "jvasp-103262",
"created_at": "2022-09-04T14:38:39.795616Z",
"updated_at": "2022-09-04T14:38:39.795633Z",
"structure_string": "K1 Hg3\n1.0\n4.512017 -0.206912 -3.635374\n-1.160764 4.365058 -3.635374\n0.166760 0.206912 5.791928\nK Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.750001 0.250000 0.500001 Hg\n0.250001 0.750000 0.500002 Hg\n0.500001 0.500000 0.000002 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Hg"
],
"chemical_system": "Hg-K",
"density": 8.888893489698868,
"density_atomic": 0.033411025519042264,
"volume": 119.72095851174164,
"volume_molar": 18.02441160199571,
"formula_full": "K1 Hg3",
"formula_reduced": "KHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.252576447368421,
"spacegroup": 139
},
{
"id": "jvasp-21685",
"created_at": "2022-09-04T14:38:33.512962Z",
"updated_at": "2022-09-04T14:38:33.512975Z",
"structure_string": "Er10 Ga6\n1.0\n4.220279 -7.309739 -0.000000\n4.220279 7.309739 0.000000\n0.000000 0.000000 6.423136\nEr Ga\n10 6\ndirect\n0.242230 -0.000000 0.250000 Er\n0.757770 -0.000000 0.750001 Er\n0.242230 0.242230 0.750001 Er\n-0.000000 0.242230 0.250000 Er\n0.757770 0.757770 0.250000 Er\n-0.000000 0.757770 0.750001 Er\n0.333333 0.666667 0.500000 Er\n0.666667 0.333333 0.000000 Er\n0.666667 0.333333 0.500000 Er\n0.333333 0.666667 0.000000 Er\n-0.000000 0.598943 0.250000 Ga\n0.598943 0.598943 0.750001 Ga\n0.401057 -0.000000 0.750001 Ga\n0.598943 -0.000000 0.250000 Ga\n0.401057 0.401057 0.250000 Ga\n-0.000000 0.401057 0.750001 Ga\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Er",
"Ga"
],
"chemical_system": "Er-Ga",
"density": 8.761289465591071,
"density_atomic": 0.040373819409661504,
"volume": 396.2964176773224,
"volume_molar": 14.915955062103674,
"formula_full": "Er10 Ga6",
"formula_reduced": "Er5Ga3",
"formula_anonymous": "A3B5",
"energy_above_hull": 0.8490849999999998,
"spacegroup": 193
},
{
"id": "jvasp-115387",
"created_at": "2022-09-04T14:38:46.140668Z",
"updated_at": "2022-09-04T14:38:46.140685Z",
"structure_string": "Pb2 S1\n1.0\n7.034471 0.489679 0.297615\n-3.283839 -4.640342 1.047511\n1.189800 1.993122 -3.359097\nPb S\n2 1\ndirect\n0.429019 0.492148 0.238743 Pb\n0.003532 0.566863 0.026392 Pb\n0.892593 0.956185 0.971225 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 8.249741780918205,
"density_atomic": 0.03338297935258838,
"volume": 89.86615509401476,
"volume_molar": 18.039554517871597,
"formula_full": "Pb2 S1",
"formula_reduced": "Pb2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6321705466666667,
"spacegroup": 38
},
{
"id": "jvasp-111279",
"created_at": "2022-09-04T14:38:47.689854Z",
"updated_at": "2022-09-04T14:38:47.689870Z",
"structure_string": "Mg2 In6\n1.0\n6.546503 -0.000000 0.000000\n-3.273252 5.669438 0.000000\n0.000000 -0.000000 5.529131\nMg In\n2 6\ndirect\n0.666667 0.333333 0.250000 Mg\n0.333334 0.666667 0.750000 Mg\n0.167728 0.335455 0.250000 In\n0.167728 0.832273 0.250000 In\n0.664545 0.832273 0.250000 In\n0.335455 0.167728 0.750000 In\n0.832272 0.167728 0.750000 In\n0.832272 0.664545 0.750000 In\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"In"
],
"chemical_system": "In-Mg",
"density": 5.9678164953331985,
"density_atomic": 0.038983760100408306,
"volume": 205.21365767167777,
"volume_molar": 15.447819154666217,
"formula_full": "Mg2 In6",
"formula_reduced": "MgIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0597633333333333,
"spacegroup": 194
},
{
"id": "jvasp-118390",
"created_at": "2022-09-04T14:38:33.166137Z",
"updated_at": "2022-09-04T14:38:33.166172Z",
"structure_string": "Ge1 P2\n1.0\n3.986927 0.000000 0.000000\n0.000000 2.575772 0.000000\n0.000000 0.000000 5.564552\nGe P\n1 2\ndirect\n0.466657 0.000000 0.000000 Ge\n-0.033328 0.000000 0.697700 P\n-0.033328 0.000000 0.302298 P\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"P"
],
"chemical_system": "Ge-P",
"density": 3.9109115505390304,
"density_atomic": 0.052498312990871994,
"volume": 57.14469340227404,
"volume_molar": 11.47111291185125,
"formula_full": "Ge1 P2",
"formula_reduced": "GeP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0573423166666664,
"spacegroup": 47
},
{
"id": "jvasp-114098",
"created_at": "2022-09-04T14:38:46.831593Z",
"updated_at": "2022-09-04T14:38:46.831621Z",
"structure_string": "Ba2 Te2\n1.0\n4.981331 0.000000 -0.000000\n0.000000 4.981331 -0.000000\n-0.000000 -0.000000 7.045218\nBa Te\n2 2\ndirect\n0.000000 0.000000 0.249997 Ba\n0.500000 0.500000 0.750004 Ba\n0.000000 0.000000 0.750012 Te\n0.500000 0.500000 0.249988 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Te"
],
"chemical_system": "Ba-Te",
"density": 5.03292058020331,
"density_atomic": 0.02288098697253155,
"volume": 174.81763373240713,
"volume_molar": 26.319409941666997,
"formula_full": "Ba2 Te2",
"formula_reduced": "BaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110478",
"created_at": "2022-09-04T14:38:39.702539Z",
"updated_at": "2022-09-04T14:38:39.702560Z",
"structure_string": "Tl3 Cu1\n1.0\n4.700699 0.000000 -0.000000\n0.000000 4.700699 -0.000000\n0.000000 0.000000 4.700699\nTl Cu\n3 1\ndirect\n0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 0.000000 Tl\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"Cu"
],
"chemical_system": "Cu-Tl",
"density": 10.818207667972093,
"density_atomic": 0.03850992410029575,
"volume": 103.86932961961566,
"volume_molar": 15.63789309040407,
"formula_full": "Tl3 Cu1",
"formula_reduced": "Tl3Cu",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-118728",
"created_at": "2022-09-04T14:38:47.341289Z",
"updated_at": "2022-09-04T14:38:47.341300Z",
"structure_string": "Mg1 Se3\n1.0\n7.478525 -0.593362 -0.763593\n0.654834 -3.715895 0.074036\n3.017493 -1.475076 -3.873639\nMg Se\n1 3\ndirect\n0.689102 0.419692 0.683258 Mg\n0.081682 0.110857 -0.083279 Se\n0.039535 0.859777 0.458201 Se\n0.565587 0.117532 0.410986 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Se"
],
"chemical_system": "Mg-Se",
"density": 4.380850258196261,
"density_atomic": 0.04040369379934884,
"volume": 99.00084927543098,
"volume_molar": 14.904926242404734,
"formula_full": "Mg1 Se3",
"formula_reduced": "MgSe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9622491833333332,
"spacegroup": 8
},
{
"id": "jvasp-120325",
"created_at": "2022-09-04T14:38:47.751558Z",
"updated_at": "2022-09-04T14:38:47.751583Z",
"structure_string": "Mg1 C2\n1.0\n4.416955 0.000000 0.632243\n0.000000 3.647241 0.000000\n0.375935 0.000000 2.524805\nMg C\n1 2\ndirect\n0.466665 0.000000 0.133352 Mg\n-0.106790 0.000000 -0.579998 C\n0.040124 0.000000 0.846647 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"C"
],
"chemical_system": "C-Mg",
"density": 2.0159254834674307,
"density_atomic": 0.07536369578930342,
"volume": 39.80696499262976,
"volume_molar": 7.990771547133625,
"formula_full": "Mg1 C2",
"formula_reduced": "MgC2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.482306349999999,
"spacegroup": 65
}
]
}