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=volume_molar&page=4607",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=4605",
"results": [
{
"id": "jvasp-114097",
"created_at": "2022-09-04T14:38:47.214780Z",
"updated_at": "2022-09-04T14:38:47.214794Z",
"structure_string": "Ba2 Te1\n1.0\n4.610206 0.000000 0.000000\n0.000000 4.439841 0.000000\n0.000000 0.000000 8.919158\nBa Te\n2 1\ndirect\n-0.033333 0.000000 0.731990 Ba\n-0.033333 0.000000 0.268011 Ba\n0.466667 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Te"
],
"chemical_system": "Ba-Te",
"density": 3.658793193427851,
"density_atomic": 0.016432727304265583,
"volume": 182.5625134801126,
"volume_molar": 36.64723845588785,
"formula_full": "Ba2 Te1",
"formula_reduced": "Ba2Te",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3710619899999999,
"spacegroup": 47
},
{
"id": "jvasp-38230",
"created_at": "2022-09-04T14:37:53.426603Z",
"updated_at": "2022-09-04T14:37:53.426613Z",
"structure_string": "Rb3 Mg1\n1.0\n-3.229838 3.229838 5.835234\n3.229838 -3.229838 5.835234\n3.229838 3.229838 -5.835234\nRb Mg\n3 1\ndirect\n0.499999 0.499999 0.000000 Rb\n0.750001 0.250001 0.500001 Rb\n0.250001 0.750001 0.500001 Rb\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Mg"
],
"chemical_system": "Mg-Rb",
"density": 1.91436505835476,
"density_atomic": 0.01642783165936183,
"volume": 243.4892250506168,
"volume_molar": 36.658159669953314,
"formula_full": "Rb3 Mg1",
"formula_reduced": "Rb3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0094924999999999,
"spacegroup": 139
},
{
"id": "jvasp-115131",
"created_at": "2022-09-04T14:38:44.476483Z",
"updated_at": "2022-09-04T14:38:44.476497Z",
"structure_string": "In1 I1\n1.0\n5.663600 -0.000000 -0.000000\n-2.831800 4.904822 -0.000000\n-0.000000 -0.000000 4.386286\nIn I\n1 1\ndirect\n0.000000 0.000000 0.000000 In\n0.333333 0.666666 0.000000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"In",
"I"
],
"chemical_system": "I-In",
"density": 3.2942256996103914,
"density_atomic": 0.016414105701566713,
"volume": 121.84641894983665,
"volume_molar": 36.68881430089238,
"formula_full": "In1 I1",
"formula_reduced": "InI",
"formula_anonymous": "AB",
"energy_above_hull": 0.17265,
"spacegroup": 187
},
{
"id": "jvasp-121276",
"created_at": "2022-09-04T14:38:55.334252Z",
"updated_at": "2022-09-04T14:38:55.334280Z",
"structure_string": "As1 Br5\n1.0\n6.004367 0.000000 0.000000\n0.000000 7.901222 0.000000\n0.000000 0.000000 7.743883\nAs Br\n1 5\ndirect\n0.815214 0.000000 0.500000 As\n0.718829 0.000000 0.183595 Br\n0.743364 0.684691 0.500000 Br\n0.743364 0.315309 0.500000 Br\n0.204628 0.000000 0.500000 Br\n0.718829 0.000000 0.816405 Br\n",
"nsites": 6,
"nelements": 2,
"elements": [
"As",
"Br"
],
"chemical_system": "As-Br",
"density": 2.1444285612086516,
"density_atomic": 0.016331684215497456,
"volume": 367.3840322179682,
"volume_molar": 36.87397258321632,
"formula_full": "As1 Br5",
"formula_reduced": "AsBr5",
"formula_anonymous": "AB5",
"energy_above_hull": null,
"spacegroup": 25
},
{
"id": "jvasp-114780",
"created_at": "2022-09-04T14:38:43.212567Z",
"updated_at": "2022-09-04T14:38:43.212596Z",
"structure_string": "Rb1 Na1 Cl1\n1.0\n4.431903 0.000000 -0.000000\n0.000000 4.431903 0.000000\n-0.000000 -0.000000 9.376430\nRb Na Cl\n1 1 1\ndirect\n0.000000 0.000000 -0.029419 Rb\n0.000000 0.000000 0.544822 Na\n0.000000 0.000000 0.280464 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Na",
"Cl"
],
"chemical_system": "Cl-Na-Rb",
"density": 1.2975490374535825,
"density_atomic": 0.016289330912266014,
"volume": 184.16962711101738,
"volume_molar": 36.96984727264196,
"formula_full": "Rb1 Na1 Cl1",
"formula_reduced": "RbNaCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0817933333333333,
"spacegroup": 99
},
{
"id": "jvasp-38187",
"created_at": "2022-09-04T14:37:44.406305Z",
"updated_at": "2022-09-04T14:37:44.406315Z",
"structure_string": "Rb3 Tm1\n1.0\n-3.146473 3.146473 6.253244\n3.146473 -3.146473 6.253244\n3.146473 3.146473 -6.253244\nRb Tm\n3 1\ndirect\n0.750000 0.250000 0.500001 Rb\n0.250000 0.750000 0.500001 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Tm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Tm"
],
"chemical_system": "Rb-Tm",
"density": 2.852131194667089,
"density_atomic": 0.01615275500909295,
"volume": 247.6357746866253,
"volume_molar": 37.28243730936256,
"formula_full": "Rb3 Tm1",
"formula_reduced": "Rb3Tm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-38238",
"created_at": "2022-09-04T14:37:48.607784Z",
"updated_at": "2022-09-04T14:37:48.607806Z",
"structure_string": "Rb3 Lu1\n1.0\n-3.169446 3.169446 6.168347\n3.169446 -3.169446 6.168347\n3.169446 3.169446 -6.168347\nRb Lu\n3 1\ndirect\n0.750002 0.250000 0.500002 Rb\n0.250000 0.750002 0.500002 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Lu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Lu"
],
"chemical_system": "Lu-Rb",
"density": 2.8900405524914166,
"density_atomic": 0.016138549158890837,
"volume": 247.8537544247819,
"volume_molar": 37.315254926012734,
"formula_full": "Rb3 Lu1",
"formula_reduced": "Rb3Lu",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-38263",
"created_at": "2022-09-04T14:37:41.075949Z",
"updated_at": "2022-09-04T14:37:41.075967Z",
"structure_string": "Rb3 Dy1\n1.0\n6.284677 -0.000000 0.000000\n0.000000 6.284677 0.000000\n-0.000000 0.000000 6.284677\nRb Dy\n3 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 Dy\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Dy"
],
"chemical_system": "Dy-Rb",
"density": 2.802296578015264,
"density_atomic": 0.01611428739886682,
"volume": 248.22692440506464,
"volume_molar": 37.37143697972947,
"formula_full": "Rb3 Dy1",
"formula_reduced": "Rb3Dy",
"formula_anonymous": "AB3",
"energy_above_hull": 2.000000000002e-05,
"spacegroup": 221
},
{
"id": "jvasp-100193",
"created_at": "2022-09-04T14:36:37.372316Z",
"updated_at": "2022-09-04T14:36:37.372345Z",
"structure_string": "K2 Ba6\n1.0\n8.874293 -0.000000 -0.000000\n-4.437147 7.685363 0.000000\n-0.000000 0.000000 7.298677\nK Ba\n2 6\ndirect\n0.666667 0.333333 0.250000 K\n0.333332 0.666667 0.750000 K\n0.836223 0.672448 0.750000 Ba\n0.163776 0.836224 0.250000 Ba\n0.672447 0.836224 0.250000 Ba\n0.163776 0.327552 0.250000 Ba\n0.327552 0.163776 0.750000 Ba\n0.836223 0.163776 0.750000 Ba\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Ba"
],
"chemical_system": "Ba-K",
"density": 3.009467776963147,
"density_atomic": 0.016071177348922397,
"volume": 497.7855589737745,
"volume_molar": 37.47168380544189,
"formula_full": "K2 Ba6",
"formula_reduced": "KBa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-38903",
"created_at": "2022-09-04T14:38:14.516213Z",
"updated_at": "2022-09-04T14:38:14.516228Z",
"structure_string": "Rb3 Sm1\n1.0\n6.295408 0.000000 -0.000000\n0.000000 6.295408 -0.000000\n0.000000 0.000000 6.295408\nRb Sm\n3 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.000000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Sm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Sm"
],
"chemical_system": "Rb-Sm",
"density": 2.7071936422662963,
"density_atomic": 0.01603202371102093,
"volume": 249.50062899734058,
"volume_molar": 37.56319768826307,
"formula_full": "Rb3 Sm1",
"formula_reduced": "Rb3Sm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-38174",
"created_at": "2022-09-04T14:37:45.145386Z",
"updated_at": "2022-09-04T14:37:45.145414Z",
"structure_string": "Rb6 Er2\n1.0\n4.450903 -7.709189 0.000000\n4.450903 7.709189 0.000000\n-0.000000 -0.000000 7.284107\nRb Er\n6 2\ndirect\n0.172673 0.827327 0.750000 Rb\n0.654653 0.827326 0.750000 Rb\n0.172673 0.345346 0.750000 Rb\n0.827327 0.172673 0.250000 Rb\n0.345346 0.172673 0.250000 Rb\n0.827326 0.654653 0.250000 Rb\n0.333333 0.666667 0.250000 Er\n0.666667 0.333333 0.750000 Er\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Rb",
"Er"
],
"chemical_system": "Er-Rb",
"density": 2.8147244143843024,
"density_atomic": 0.016003937691792924,
"volume": 499.87697740803674,
"volume_molar": 37.62911900793171,
"formula_full": "Rb6 Er2",
"formula_reduced": "Rb3Er",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-38189",
"created_at": "2022-09-04T14:38:01.089431Z",
"updated_at": "2022-09-04T14:38:01.089454Z",
"structure_string": "Rb3 Tm1\n1.0\n0.000000 5.000746 5.000746\n5.000746 0.000000 5.000746\n5.000746 5.000746 0.000000\nRb Tm\n3 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 Rb\n0.250000 0.250000 0.250000 Rb\n0.750001 0.750001 0.750001 Tm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Tm"
],
"chemical_system": "Rb-Tm",
"density": 2.823894707731428,
"density_atomic": 0.01599284053649015,
"volume": 250.1119166963104,
"volume_molar": 37.65522920246439,
"formula_full": "Rb3 Tm1",
"formula_reduced": "Rb3Tm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0004925,
"spacegroup": 225
}
]
}