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&page=4163",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=4161",
"results": [
{
"id": "jvasp-96665",
"created_at": "2022-09-04T14:35:41.365769Z",
"updated_at": "2022-09-04T14:35:41.365787Z",
"structure_string": "Ta6 Fe16 Si7\n1.0\n6.861847 -0.000000 3.961689\n2.287282 6.469410 3.961689\n-0.000000 -0.000000 7.923377\nTa Fe Si\n6 16 7\ndirect\n0.796826 0.796826 0.203174 Ta\n0.203174 0.796826 0.796826 Ta\n0.203174 0.796826 0.203174 Ta\n0.796826 0.203174 0.796826 Ta\n0.203174 0.203174 0.796826 Ta\n0.796826 0.203174 0.203174 Ta\n0.172923 0.172923 0.481232 Fe\n0.827077 0.827077 0.827077 Fe\n0.827077 0.827077 0.518768 Fe\n0.380257 0.380257 0.380257 Fe\n0.619743 0.619743 0.140772 Fe\n0.140772 0.619743 0.619743 Fe\n0.619743 0.140772 0.619743 Fe\n0.859228 0.380257 0.380257 Fe\n0.380257 0.859228 0.380257 Fe\n0.172923 0.481232 0.172923 Fe\n0.481232 0.172923 0.172923 Fe\n0.619743 0.619743 0.619743 Fe\n0.518768 0.827077 0.827077 Fe\n0.380257 0.380257 0.859228 Fe\n0.172923 0.172923 0.172923 Fe\n0.827077 0.518768 0.827077 Fe\n0.500000 0.000000 0.500000 Si\n-0.000000 0.500000 0.000000 Si\n-0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.000000 0.000000 0.500000 Si\n0.500000 0.000000 -0.000000 Si\n0.500000 0.500000 0.500000 Si\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Ta",
"Fe",
"Si"
],
"chemical_system": "Fe-Si-Ta",
"density": 10.271957109690604,
"density_atomic": 0.08244835055461093,
"volume": 351.7353568012426,
"volume_molar": 7.304137341123814,
"formula_full": "Ta6 Fe16 Si7",
"formula_reduced": "Ta6Fe16Si7",
"formula_anonymous": "A6B7C16",
"energy_above_hull": 5.177431151724138,
"spacegroup": 225
},
{
"id": "jvasp-8749",
"created_at": "2022-09-04T14:37:07.402541Z",
"updated_at": "2022-09-04T14:37:07.402563Z",
"structure_string": "Sm2 Ge1 Rh3\n1.0\n4.711188 -0.021920 2.102096\n1.355358 4.512071 2.102096\n-0.029617 -0.021920 5.158801\nSm Ge Rh\n2 1 3\ndirect\n0.871794 0.871794 0.871795 Sm\n0.128206 0.128206 0.128206 Sm\n0.500000 0.500000 0.500001 Ge\n0.500000 0.000000 0.500000 Rh\n0.500001 0.500000 0.000000 Rh\n-0.000000 0.500000 0.500000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Ge",
"Rh"
],
"chemical_system": "Ge-Rh-Sm",
"density": 10.272970838290766,
"density_atomic": 0.05442082502441427,
"volume": 110.25191178759749,
"volume_molar": 11.06587553073359,
"formula_full": "Sm2 Ge1 Rh3",
"formula_reduced": "Sm2GeRh3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.1771221166666668,
"spacegroup": 166
},
{
"id": "jvasp-41047",
"created_at": "2022-09-04T14:37:37.840376Z",
"updated_at": "2022-09-04T14:37:37.840398Z",
"structure_string": "Nd2 Ni1 Ir1\n1.0\n-0.000000 3.519410 3.519408\n3.519403 0.000000 3.519408\n3.519404 3.519411 -0.000001\nNd Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.499999 0.499998 Nd\n0.750002 0.750001 0.750000 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Ni",
"Ir"
],
"chemical_system": "Ir-Nd-Ni",
"density": 10.273463197266183,
"density_atomic": 0.0458797803521853,
"volume": 87.1843755417952,
"volume_molar": 13.125914539634799,
"formula_full": "Nd2 Ni1 Ir1",
"formula_reduced": "Nd2NiIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.096701625,
"spacegroup": 225
},
{
"id": "jvasp-67621",
"created_at": "2022-09-04T14:35:53.004743Z",
"updated_at": "2022-09-04T14:35:53.004755Z",
"structure_string": "Ta1 Be1 Cr1\n1.0\n-1.317371 1.317371 5.633560\n1.317371 -1.317371 5.633560\n1.317371 1.317371 -5.633560\nTa Be Cr\n1 1 1\ndirect\n0.654575 0.654575 0.000000 Ta\n0.990868 0.990868 0.000000 Be\n0.354556 0.354556 0.000000 Cr\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Cr"
],
"chemical_system": "Be-Cr-Ta",
"density": 10.273695066037751,
"density_atomic": 0.07671179438824666,
"volume": 39.107415279802694,
"volume_molar": 7.850345319158221,
"formula_full": "Ta1 Be1 Cr1",
"formula_reduced": "TaBeCr",
"formula_anonymous": "ABC",
"energy_above_hull": 4.0348309,
"spacegroup": 107
},
{
"id": "jvasp-102665",
"created_at": "2022-09-04T14:36:50.189465Z",
"updated_at": "2022-09-04T14:36:50.189494Z",
"structure_string": "Th1 U1 Se2\n1.0\n4.152750 0.000000 0.000000\n0.000000 4.152750 0.000000\n0.000000 -0.000000 5.885647\nTh U Se\n1 1 2\ndirect\n0.500000 0.500000 -0.000000 Th\n0.000000 0.000000 0.500000 U\n0.000000 0.000000 0.000000 Se\n0.500000 0.500000 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"U",
"Se"
],
"chemical_system": "Se-Th-U",
"density": 10.273867141538876,
"density_atomic": 0.03940889034514022,
"volume": 101.49993986048042,
"volume_molar": 15.281173124283697,
"formula_full": "Th1 U1 Se2",
"formula_reduced": "ThUSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.697847083333333,
"spacegroup": 123
},
{
"id": "jvasp-116992",
"created_at": "2022-09-04T14:38:46.961899Z",
"updated_at": "2022-09-04T14:38:46.961919Z",
"structure_string": "Zr2 Ta2 Fe8\n1.0\n4.810475 -0.002118 -0.000020\n2.406952 4.164887 0.000009\n0.000030 -0.000001 7.992899\nZr Ta Fe\n2 2 8\ndirect\n0.666662 0.666688 0.069986 Zr\n0.333350 0.333308 0.930017 Zr\n0.333338 0.333320 0.558009 Ta\n0.666667 0.666672 0.441988 Ta\n0.000004 -0.000004 0.499999 Fe\n0.000007 -0.000002 0.000001 Fe\n0.831408 0.337202 0.742764 Fe\n0.337187 0.831400 0.742771 Fe\n0.831411 0.831411 0.742775 Fe\n0.168602 0.662793 0.257237 Fe\n0.662823 0.168594 0.257229 Fe\n0.168598 0.168583 0.257226 Fe\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zr",
"Ta",
"Fe"
],
"chemical_system": "Fe-Ta-Zr",
"density": 10.274536023418856,
"density_atomic": 0.07491611437103407,
"volume": 160.17915639041388,
"volume_molar": 8.038511888342715,
"formula_full": "Zr2 Ta2 Fe8",
"formula_reduced": "ZrTaFe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.534742616666668,
"spacegroup": 164
},
{
"id": "jvasp-102275",
"created_at": "2022-09-04T14:36:48.077216Z",
"updated_at": "2022-09-04T14:36:48.077244Z",
"structure_string": "Cr1 Sn1 Rh2\n1.0\n3.823444 -0.000000 2.207466\n1.274481 3.604778 2.207466\n-0.000000 -0.000000 4.414933\nCr Sn Rh\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Cr\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Rh\n0.749999 0.750000 0.750001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Sn",
"Rh"
],
"chemical_system": "Cr-Rh-Sn",
"density": 10.27487217451571,
"density_atomic": 0.06573590049145091,
"volume": 60.84955055145565,
"volume_molar": 9.16111396509004,
"formula_full": "Cr1 Sn1 Rh2",
"formula_reduced": "CrSnRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.760888775,
"spacegroup": 225
},
{
"id": "jvasp-105250",
"created_at": "2022-09-04T14:36:58.349384Z",
"updated_at": "2022-09-04T14:36:58.349410Z",
"structure_string": "Sm1 Hf1\n1.0\n3.351213 0.000000 0.000000\n-1.675607 2.902235 0.000000\n-0.000000 -0.000000 5.463568\nSm Hf\n1 1\ndirect\n0.333333 0.666668 -0.000000 Sm\n0.666666 0.333334 0.500000 Hf\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"Hf"
],
"chemical_system": "Hf-Sm",
"density": 10.276281290984844,
"density_atomic": 0.037637349822138635,
"volume": 53.13870422469495,
"volume_molar": 16.000437832255983,
"formula_full": "Sm1 Hf1",
"formula_reduced": "SmHf",
"formula_anonymous": "AB",
"energy_above_hull": 2.4402359375,
"spacegroup": 187
},
{
"id": "jvasp-106273",
"created_at": "2022-09-04T14:38:38.652553Z",
"updated_at": "2022-09-04T14:38:38.652573Z",
"structure_string": "Pm1 Sm1 Tl2\n1.0\n4.710320 -0.000000 2.719505\n1.570107 4.440932 2.719505\n0.000000 0.000000 5.439009\nPm Sm Tl\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Pm\n0.000000 0.000000 0.000000 Sm\n0.750001 0.750000 0.749999 Tl\n0.250000 0.250000 0.250000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Sm",
"Tl"
],
"chemical_system": "Pm-Sm-Tl",
"density": 10.276743938447797,
"density_atomic": 0.03515731322929518,
"volume": 113.77433690430475,
"volume_molar": 17.129126792834647,
"formula_full": "Pm1 Sm1 Tl2",
"formula_reduced": "PmSmTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3571763124999998,
"spacegroup": 225
},
{
"id": "jvasp-82082",
"created_at": "2022-09-04T14:37:15.561397Z",
"updated_at": "2022-09-04T14:37:15.561428Z",
"structure_string": "Hf1 Sc1 Hg2\n1.0\n-10.219633 0.000000 -5.900309\n-6.668809 0.263444 -0.249901\n-5.753669 2.851849 -1.834969\nHf Sc Hg\n1 1 2\ndirect\n0.500000 -0.000000 0.000000 Hf\n0.000000 0.000000 0.000000 Sc\n0.746750 -0.000001 0.000000 Hg\n0.253250 -0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Sc",
"Hg"
],
"chemical_system": "Hf-Hg-Sc",
"density": 10.276778147757963,
"density_atomic": 0.03963217240752431,
"volume": 100.92810353339564,
"volume_molar": 15.195081152949047,
"formula_full": "Hf1 Sc1 Hg2",
"formula_reduced": "HfScHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3085343625,
"spacegroup": 71
},
{
"id": "jvasp-109642",
"created_at": "2022-09-04T14:38:18.940024Z",
"updated_at": "2022-09-04T14:38:18.940049Z",
"structure_string": "Er6 Co1 Bi2\n1.0\n8.268687 -0.000000 0.000000\n-4.134343 7.160893 0.000000\n-0.000000 -0.000000 4.039386\nEr Co Bi\n6 1 2\ndirect\n0.230448 0.000000 0.500001 Er\n0.000000 0.230448 0.500001 Er\n0.769552 0.769551 0.500001 Er\n0.609504 0.000000 -0.000000 Er\n0.000000 0.609504 -0.000000 Er\n0.390496 0.390496 -0.000000 Er\n0.000000 0.000000 0.000000 Co\n0.333334 0.666666 0.500001 Bi\n0.666667 0.333333 0.500001 Bi\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Er",
"Co",
"Bi"
],
"chemical_system": "Bi-Co-Er",
"density": 10.27834428156754,
"density_atomic": 0.03762906407141858,
"volume": 239.17682307798916,
"volume_molar": 16.003961056725192,
"formula_full": "Er6 Co1 Bi2",
"formula_reduced": "Er6CoBi2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.6914888333333336,
"spacegroup": 189
},
{
"id": "jvasp-71159",
"created_at": "2022-09-04T14:35:46.519424Z",
"updated_at": "2022-09-04T14:35:46.519443Z",
"structure_string": "Be1 Mo4 Os1\n1.0\n-0.000000 3.611211 3.611211\n3.611211 0.000000 3.611211\n3.611211 3.611211 0.000000\nBe Mo Os\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.121265 0.626244 0.626244 Mo\n0.626244 0.626244 0.626244 Mo\n0.626244 0.121265 0.626244 Mo\n0.626244 0.626244 0.121265 Mo\n0.250000 0.250000 0.250000 Os\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Mo",
"Os"
],
"chemical_system": "Be-Mo-Os",
"density": 10.278522434000235,
"density_atomic": 0.06370340712422044,
"volume": 94.18648500699678,
"volume_molar": 9.453404506696069,
"formula_full": "Be1 Mo4 Os1",
"formula_reduced": "BeMo4Os",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.962892450000001,
"spacegroup": 216
}
]
}