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=709",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=707",
"results": [
{
"id": "jvasp-110550",
"created_at": "2022-09-04T14:38:37.360503Z",
"updated_at": "2022-09-04T14:38:37.360523Z",
"structure_string": "Pr2 In1 Ag1\n1.0\n3.736483 -0.000000 0.000000\n0.000000 3.736483 -0.000000\n-0.000000 -0.000000 8.019977\nPr In Ag\n2 1 1\ndirect\n0.500000 0.500000 0.239926 Pr\n0.500000 0.500000 0.760074 Pr\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"In",
"Ag"
],
"chemical_system": "Ag-In-Pr",
"density": 7.481908886980623,
"density_atomic": 0.03572406304953545,
"volume": 111.969346668478,
"volume_molar": 16.857379161070288,
"formula_full": "Pr2 In1 Ag1",
"formula_reduced": "Pr2InAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5540042325000001,
"spacegroup": 123
},
{
"id": "jvasp-36088",
"created_at": "2022-09-04T14:37:30.202879Z",
"updated_at": "2022-09-04T14:37:30.202904Z",
"structure_string": "Ce1 Y1 Tl2\n1.0\n-0.000000 3.825353 3.825353\n3.825353 0.000000 3.825353\n3.825353 3.825353 -0.000000\nCe Y Tl\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ce\n0.749999 0.749999 0.749999 Y\n0.500001 0.500001 0.500001 Tl\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Y",
"Tl"
],
"chemical_system": "Ce-Tl-Y",
"density": 9.459783542777856,
"density_atomic": 0.03572855423984345,
"volume": 111.9552717736145,
"volume_molar": 16.855260136119036,
"formula_full": "Ce1 Y1 Tl2",
"formula_reduced": "CeYTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8708190374999999,
"spacegroup": 225
},
{
"id": "jvasp-28550",
"created_at": "2022-09-04T14:37:52.663568Z",
"updated_at": "2022-09-04T14:37:52.663587Z",
"structure_string": "Mo3 Se2 S4\n1.0\n3.233971 0.000000 0.000000\n-1.616986 2.800692 0.000000\n0.000000 0.000000 27.810045\nMo Se S\n3 2 4\ndirect\n0.333324 0.666652 0.115606 Mo\n0.333324 0.666652 0.578359 Mo\n0.666660 0.333323 0.346982 Mo\n0.333328 0.666661 0.408356 Se\n0.333328 0.666661 0.285609 Se\n0.666665 0.333329 0.059806 S\n0.666648 0.333296 0.522485 S\n0.666648 0.333296 0.171480 S\n0.666665 0.333329 0.634157 S\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mo",
"Se",
"S"
],
"chemical_system": "Mo-S-Se",
"density": 3.7840583646210746,
"density_atomic": 0.03573052075141245,
"volume": 251.88549762864076,
"volume_molar": 16.854332468025788,
"formula_full": "Mo3 Se2 S4",
"formula_reduced": "Mo3(SeS2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 3.6320071592592575,
"spacegroup": 187
},
{
"id": "jvasp-101728",
"created_at": "2022-09-04T14:36:43.944813Z",
"updated_at": "2022-09-04T14:36:43.944826Z",
"structure_string": "Er3 Mg1\n1.0\n3.484397 -0.000000 0.000000\n0.000000 3.484397 0.000000\n0.000000 0.000000 9.220717\nEr Mg\n3 1\ndirect\n0.500000 0.500000 0.759424 Er\n0.000000 0.000000 0.500000 Er\n0.500000 0.500000 0.240576 Er\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Er",
"Mg"
],
"chemical_system": "Er-Mg",
"density": 7.803376919921709,
"density_atomic": 0.03573057753836366,
"volume": 111.94893213537424,
"volume_molar": 16.854305681272777,
"formula_full": "Er3 Mg1",
"formula_reduced": "Er3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9851895833333334,
"spacegroup": 123
},
{
"id": "jvasp-86710",
"created_at": "2022-09-04T14:36:11.828504Z",
"updated_at": "2022-09-04T14:36:11.828523Z",
"structure_string": "Th4 Ga2\n1.0\n5.194741 0.000000 2.921502\n2.597370 5.307723 1.460752\n-0.004435 -0.000000 6.087038\nTh Ga\n4 2\ndirect\n0.159094 0.500000 0.181811 Th\n0.840905 0.500000 0.818189 Th\n0.340905 0.818189 0.500000 Th\n0.659094 0.181811 0.500000 Th\n0.250000 -0.000000 -0.000000 Ga\n0.750000 -0.000000 -0.000000 Ga\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Ga"
],
"chemical_system": "Ga-Th",
"density": 10.558466938262416,
"density_atomic": 0.0357351136888326,
"volume": 167.9020823116908,
"volume_molar": 16.852166226301804,
"formula_full": "Th4 Ga2",
"formula_reduced": "Th2Ga",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7436178416666672,
"spacegroup": 140
},
{
"id": "jvasp-28559",
"created_at": "2022-09-04T14:37:56.734242Z",
"updated_at": "2022-09-04T14:37:56.734262Z",
"structure_string": "Mo2 W1 Se2 S4\n1.0\n3.233939 -0.000000 0.000000\n-1.616970 2.800686 -0.000052\n0.000000 -0.000509 27.806723\nMo W Se S\n2 1 2 4\ndirect\n0.333384 0.666766 0.115371 Mo\n0.666633 0.333266 0.346698 Mo\n0.333299 0.666597 0.578873 W\n0.333300 0.666601 0.408077 Se\n0.333286 0.666572 0.285320 Se\n0.666708 0.333413 0.059564 S\n0.666619 0.333238 0.522709 S\n0.666734 0.333466 0.171253 S\n0.666643 0.333284 0.634976 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 4.364107338306645,
"density_atomic": 0.03573521955416591,
"volume": 251.85237735445241,
"volume_molar": 16.85211630187943,
"formula_full": "Mo2 W1 Se2 S4",
"formula_reduced": "Mo2W(SeS2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.891090948148148,
"spacegroup": 156
},
{
"id": "jvasp-112991",
"created_at": "2022-09-04T14:38:44.676239Z",
"updated_at": "2022-09-04T14:38:44.676255Z",
"structure_string": "Sm12 Rh4\n1.0\n6.383245 -0.000000 0.000000\n0.000000 7.218669 0.000000\n-0.000000 -0.000000 9.716702\nSm Rh\n12 4\ndirect\n0.331565 0.678082 0.063839 Sm\n0.168435 0.178082 0.436161 Sm\n0.668435 0.321919 0.563839 Sm\n0.831564 0.821919 0.936161 Sm\n0.668435 0.321919 0.936161 Sm\n0.831564 0.821919 0.563839 Sm\n0.331565 0.678082 0.436161 Sm\n0.168435 0.178082 0.063839 Sm\n0.857218 0.533789 0.250000 Sm\n0.642781 0.033789 0.250000 Sm\n0.142781 0.466211 0.750000 Sm\n0.357218 0.966211 0.750000 Sm\n0.065506 0.880859 0.250000 Rh\n0.434493 0.380859 0.250000 Rh\n0.934493 0.119142 0.750000 Rh\n0.565506 0.619142 0.750000 Rh\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sm",
"Rh"
],
"chemical_system": "Rh-Sm",
"density": 8.21845082092955,
"density_atomic": 0.03573571343645558,
"volume": 447.7313718236192,
"volume_molar": 16.851883398685832,
"formula_full": "Sm12 Rh4",
"formula_reduced": "Sm3Rh",
"formula_anonymous": "AB3",
"energy_above_hull": 1.7440874062499998,
"spacegroup": 62
},
{
"id": "jvasp-19782",
"created_at": "2022-09-04T14:38:30.819649Z",
"updated_at": "2022-09-04T14:38:30.819663Z",
"structure_string": "Sn1 Sb1\n1.0\n3.825081 -0.000000 -0.000000\n-0.000000 3.825081 -0.000000\n0.000000 0.000000 3.825081\nSn Sb\n1 1\ndirect\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 7.134903312163997,
"density_atomic": 0.035736176712014324,
"volume": 55.965695942163,
"volume_molar": 16.851664934753323,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.7430789000000002,
"spacegroup": 221
},
{
"id": "jvasp-86109",
"created_at": "2022-09-04T14:35:47.534907Z",
"updated_at": "2022-09-04T14:35:47.534923Z",
"structure_string": "Th4 Ga2\n1.0\n5.194505 0.000000 2.921370\n2.597252 5.307701 1.460685\n-0.004543 -0.000000 6.086953\nTh Ga\n4 2\ndirect\n0.159088 0.500000 0.181823 Th\n0.840913 0.500000 0.818176 Th\n0.340912 0.818177 0.499999 Th\n0.659089 0.181823 0.499999 Th\n0.250000 -0.000000 -0.000000 Ga\n0.750001 -0.000000 -0.000000 Ga\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Ga"
],
"chemical_system": "Ga-Th",
"density": 10.559032470131045,
"density_atomic": 0.03573702773049587,
"volume": 167.89308963375134,
"volume_molar": 16.85126364009579,
"formula_full": "Th4 Ga2",
"formula_reduced": "Th2Ga",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7436111750000003,
"spacegroup": 140
},
{
"id": "jvasp-110773",
"created_at": "2022-09-04T14:38:38.242298Z",
"updated_at": "2022-09-04T14:38:38.242319Z",
"structure_string": "Dy3 Zr1\n1.0\n4.819094 -0.000000 0.000000\n0.000000 4.819094 0.000000\n-0.000000 -0.000000 4.819094\nDy Zr\n3 1\ndirect\n-0.000000 0.500000 0.500000 Dy\n0.500000 0.000000 0.500000 Dy\n0.500000 0.500000 -0.000000 Dy\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Dy",
"Zr"
],
"chemical_system": "Dy-Zr",
"density": 8.586662589859122,
"density_atomic": 0.03574076125588548,
"volume": 111.91703420534486,
"volume_molar": 16.84950333565804,
"formula_full": "Dy3 Zr1",
"formula_reduced": "Dy3Zr",
"formula_anonymous": "AB3",
"energy_above_hull": 2.149996,
"spacegroup": 221
},
{
"id": "jvasp-18036",
"created_at": "2022-09-04T14:37:33.217706Z",
"updated_at": "2022-09-04T14:37:33.217728Z",
"structure_string": "Y4 In2\n1.0\n2.686835 -4.653736 -0.000000\n2.686835 4.653736 0.000000\n-0.000000 -0.000000 6.712840\nY In\n4 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.000000 0.500000 Y\n0.333334 0.666668 0.250000 Y\n0.666668 0.333334 0.750000 Y\n0.333334 0.666668 0.750000 In\n0.666668 0.333334 0.250000 In\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"In"
],
"chemical_system": "In-Y",
"density": 5.789198806332558,
"density_atomic": 0.03574145424549184,
"volume": 167.8722963757636,
"volume_molar": 16.84917664132144,
"formula_full": "Y4 In2",
"formula_reduced": "Y2In",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4396769566666665,
"spacegroup": 194
},
{
"id": "jvasp-109479",
"created_at": "2022-09-04T14:38:18.537624Z",
"updated_at": "2022-09-04T14:38:18.537643Z",
"structure_string": "Na2 Li1 Pr1 Cl6\n1.0\n6.357788 -0.000000 3.670671\n2.119263 5.994180 3.670671\n-0.000000 -0.000000 7.341342\nNa Li Pr Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.738551 0.261449 0.261449 Cl\n0.261449 0.261449 0.738551 Cl\n0.261449 0.738551 0.738551 Cl\n0.261449 0.738551 0.261449 Cl\n0.738551 0.261449 0.738551 Cl\n0.738551 0.738551 0.261449 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Li",
"Pr",
"Cl"
],
"chemical_system": "Cl-Li-Na-Pr",
"density": 2.412946608531838,
"density_atomic": 0.035742812346697024,
"volume": 279.7765296978399,
"volume_molar": 16.848536431847126,
"formula_full": "Na2 Li1 Pr1 Cl6",
"formula_reduced": "Na2LiPrCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}