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=84",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=82",
"results": [
{
"id": "jvasp-10117",
"created_at": "2022-09-04T14:38:15.208637Z",
"updated_at": "2022-09-04T14:38:15.208658Z",
"structure_string": "Na4 Cd4 As4\n1.0\n4.494983 -0.000000 0.000000\n-0.000000 7.570547 0.000000\n0.000000 0.000000 8.164206\nNa Cd As\n4 4 4\ndirect\n0.250000 0.517907 0.675136 Na\n0.750000 0.482093 0.324865 Na\n0.250000 0.017907 0.824865 Na\n0.750000 0.982094 0.175135 Na\n0.750000 0.848894 0.575179 Cd\n0.750000 0.348894 0.924822 Cd\n0.250000 0.651106 0.075178 Cd\n0.250000 0.151106 0.424822 Cd\n0.250000 0.775842 0.391876 As\n0.750000 0.724159 0.891876 As\n0.750000 0.224159 0.608125 As\n0.250000 0.275841 0.108125 As\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Cd",
"As"
],
"chemical_system": "As-Cd-Na",
"density": 5.028347534233915,
"density_atomic": 0.04319286163732803,
"volume": 277.8236853292765,
"volume_molar": 13.942444495957083,
"formula_full": "Na4 Cd4 As4",
"formula_reduced": "NaCdAs",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-101171",
"created_at": "2022-09-04T14:36:57.937405Z",
"updated_at": "2022-09-04T14:36:57.937425Z",
"structure_string": "Li1 Zr2 S4\n1.0\n3.634464 0.000000 0.000000\n-0.000000 5.965483 1.962395\n-0.000000 0.022198 6.503587\nLi Zr S\n1 2 4\ndirect\n0.000000 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.000000 Zr\n0.500000 0.752409 0.249383 S\n0.000000 0.252336 0.245303 S\n0.500000 0.247591 0.750618 S\n0.000000 0.747664 0.754698 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Li",
"Zr",
"S"
],
"chemical_system": "Li-S-Zr",
"density": 3.7449459223237183,
"density_atomic": 0.049698925680328306,
"volume": 140.84811500806185,
"volume_molar": 12.117245347988813,
"formula_full": "Li1 Zr2 S4",
"formula_reduced": "Li(ZrS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.507884142857143,
"spacegroup": 10
},
{
"id": "jvasp-101172",
"created_at": "2022-09-04T14:36:58.969920Z",
"updated_at": "2022-09-04T14:36:58.969947Z",
"structure_string": "La1 Y1 Mg6\n1.0\n4.975208 -0.004626 7.534909\n2.259745 4.432412 7.534909\n-0.007559 -0.004626 9.029258\nLa Y Mg\n1 1 6\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.499999 0.500001 Y\n0.622428 0.622427 0.622429 Mg\n0.127244 0.127244 0.127245 Mg\n0.872756 0.872754 0.872757 Mg\n0.377572 0.377571 0.377573 Mg\n0.249045 0.249045 0.249046 Mg\n0.750955 0.750953 0.750956 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
"La",
"Y",
"Mg"
],
"chemical_system": "La-Mg-Y",
"density": 3.1091244588154128,
"density_atomic": 0.04008889624480657,
"volume": 199.55650440329555,
"volume_molar": 15.02196698862757,
"formula_full": "La1 Y1 Mg6",
"formula_reduced": "LaYMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-101173",
"created_at": "2022-09-04T14:36:39.992725Z",
"updated_at": "2022-09-04T14:36:39.992751Z",
"structure_string": "La1 Y1 Mn2 Si2\n1.0\n3.981124 -0.000000 0.000000\n0.000000 3.981124 0.000000\n-0.000000 -0.000000 7.368951\nLa Y Mn Si\n1 1 2 2\ndirect\n0.500000 0.500000 0.339406 La\n0.000000 0.000000 0.689429 Y\n0.500000 0.000000 0.993848 Mn\n-0.000000 0.500000 0.993848 Mn\n0.500000 0.500000 0.806378 Si\n0.000000 0.000000 0.177091 Si\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"Y",
"Mn",
"Si"
],
"chemical_system": "La-Mn-Si-Y",
"density": 5.599795182615801,
"density_atomic": 0.05137291062826784,
"volume": 116.79307102951087,
"volume_molar": 11.722405225539877,
"formula_full": "La1 Y1 Mn2 Si2",
"formula_reduced": "LaY(MnSi)2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.528438688793103,
"spacegroup": 99
},
{
"id": "jvasp-101175",
"created_at": "2022-09-04T14:37:01.135193Z",
"updated_at": "2022-09-04T14:37:01.135212Z",
"structure_string": "La1 Nd1 Cu1 O4\n1.0\n3.805125 -0.011443 -5.662493\n-0.362927 3.787795 -5.662493\n0.010431 0.011443 6.822221\nLa Nd Cu O\n1 1 1 4\ndirect\n0.350343 0.350343 0.000001 La\n0.647857 0.647858 0.000002 Nd\n0.002849 0.002849 0.000000 Cu\n0.747442 0.247442 0.500001 O\n0.247441 0.747443 0.500001 O\n0.002034 0.502034 0.500000 O\n0.502035 0.002034 0.500001 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"La",
"Nd",
"Cu",
"O"
],
"chemical_system": "Cu-La-Nd-O",
"density": 6.902862150945854,
"density_atomic": 0.07085375699541412,
"volume": 98.79504343648372,
"volume_molar": 8.49939511378313,
"formula_full": "La1 Nd1 Cu1 O4",
"formula_reduced": "LaNdCuO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.6684815642857145,
"spacegroup": 107
},
{
"id": "jvasp-101176",
"created_at": "2022-09-04T14:37:01.870968Z",
"updated_at": "2022-09-04T14:37:01.870981Z",
"structure_string": "La1 Cu1 Ge1\n1.0\n4.258302 -0.000000 0.000000\n-2.129151 3.687798 0.000000\n-0.000000 0.000000 4.223802\nLa Cu Ge\n1 1 1\ndirect\n0.333333 0.666667 -0.000000 La\n0.666667 0.333334 0.500000 Cu\n0.000000 0.000000 0.500000 Ge\n",
"nsites": 3,
"nelements": 3,
"elements": [
"La",
"Cu",
"Ge"
],
"chemical_system": "Cu-Ge-La",
"density": 6.8868256303228925,
"density_atomic": 0.045228701583926806,
"volume": 66.3295627541545,
"volume_molar": 13.314865448492387,
"formula_full": "La1 Cu1 Ge1",
"formula_reduced": "LaCuGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4430871333333332,
"spacegroup": 187
},
{
"id": "jvasp-101177",
"created_at": "2022-09-04T14:36:40.972187Z",
"updated_at": "2022-09-04T14:36:40.972207Z",
"structure_string": "La2 Mg1 Al1\n1.0\n3.841680 -0.000000 0.000000\n0.000000 3.841680 0.000000\n-0.000000 -0.000000 7.883096\nLa Mg Al\n2 1 1\ndirect\n0.500000 0.500000 0.234846 La\n0.500000 0.500000 0.765155 La\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Mg",
"Al"
],
"chemical_system": "Al-La-Mg",
"density": 4.697150372092835,
"density_atomic": 0.034381181942491824,
"volume": 116.34271348468057,
"volume_molar": 17.515804925127412,
"formula_full": "La2 Mg1 Al1",
"formula_reduced": "La2MgAl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0744454625,
"spacegroup": 123
},
{
"id": "jvasp-101178",
"created_at": "2022-09-04T14:37:02.994412Z",
"updated_at": "2022-09-04T14:37:02.994432Z",
"structure_string": "La2 Al3 Sn1\n1.0\n4.448496 -0.000000 0.000000\n0.000000 4.503369 0.000000\n0.000000 0.000000 7.817540\nLa Al Sn\n2 3 1\ndirect\n-0.000000 0.500000 0.997140 La\n0.000000 0.000000 0.503721 La\n0.500001 0.000000 0.829517 Al\n0.500001 0.000000 0.154024 Al\n0.500001 0.500000 0.678700 Al\n0.500001 0.500000 0.336897 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Al",
"Sn"
],
"chemical_system": "Al-La-Sn",
"density": 5.062561292499984,
"density_atomic": 0.03831160972734392,
"volume": 156.61049072854945,
"volume_molar": 15.718840327666662,
"formula_full": "La2 Al3 Sn1",
"formula_reduced": "La2Al3Sn",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.605510016666667,
"spacegroup": 25
},
{
"id": "jvasp-101179",
"created_at": "2022-09-04T14:37:03.639309Z",
"updated_at": "2022-09-04T14:37:03.639328Z",
"structure_string": "K1 Tl1 Co4 Se4\n1.0\n3.860117 -0.000000 0.000000\n0.000000 3.860117 0.000000\n-0.000000 -0.000000 13.307244\nK Tl Co Se\n1 1 4 4\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Tl\n-0.000000 0.500000 0.253239 Co\n0.500000 0.000000 0.746760 Co\n0.500000 0.000000 0.253239 Co\n-0.000000 0.500000 0.746760 Co\n0.500000 0.500000 0.152348 Se\n0.000000 0.000000 0.646186 Se\n0.000000 0.000000 0.353814 Se\n0.500000 0.500000 0.847652 Se\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Co",
"Se"
],
"chemical_system": "Co-K-Se-Tl",
"density": 6.658200594192383,
"density_atomic": 0.05043255179651825,
"volume": 198.28463251963342,
"volume_molar": 11.94097967578106,
"formula_full": "K1 Tl1 Co4 Se4",
"formula_reduced": "KTl(CoSe)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 2.015100766666668,
"spacegroup": 123
},
{
"id": "jvasp-10118",
"created_at": "2022-09-04T14:38:08.996031Z",
"updated_at": "2022-09-04T14:38:08.996058Z",
"structure_string": "Na2 Ag2 F8\n1.0\n5.034058 -0.000000 -2.338677\n-1.086481 4.915414 -2.338677\n-0.010465 -0.013031 6.564777\nNa Ag F\n2 2 8\ndirect\n0.250001 0.250000 0.500000 Na\n0.750001 0.749999 0.500000 Na\n0.000000 0.500000 -0.000000 Ag\n0.500000 0.000000 -0.000000 Ag\n0.948657 0.448656 0.255889 F\n0.692768 0.192767 0.744111 F\n0.051344 0.551343 0.744110 F\n0.192767 0.051344 0.744111 F\n0.307234 0.807233 0.255889 F\n0.448657 0.307233 0.255890 F\n0.807234 0.948656 0.255889 F\n0.551345 0.692766 0.744110 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Ag",
"F"
],
"chemical_system": "Ag-F-Na",
"density": 4.237022125465346,
"density_atomic": 0.07401232341090673,
"volume": 162.13516137545867,
"volume_molar": 8.136673032902728,
"formula_full": "Na2 Ag2 F8",
"formula_reduced": "NaAgF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 140
},
{
"id": "jvasp-101181",
"created_at": "2022-09-04T14:36:41.703087Z",
"updated_at": "2022-09-04T14:36:41.703105Z",
"structure_string": "La2 Al3 Ge1\n1.0\n4.380415 0.000000 0.000000\n-2.190208 3.793551 0.000000\n-0.000000 -0.000000 8.876731\nLa Al Ge\n2 3 1\ndirect\n0.666667 0.333333 0.249151 La\n0.666667 0.333333 0.750849 La\n0.000000 0.000000 0.500000 Al\n0.333333 0.666667 -0.000000 Al\n0.333333 0.666667 0.500000 Al\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Al",
"Ge"
],
"chemical_system": "Al-Ge-La",
"density": 4.8563560539761665,
"density_atomic": 0.04067588460932769,
"volume": 147.5075479642819,
"volume_molar": 14.805186950055953,
"formula_full": "La2 Al3 Ge1",
"formula_reduced": "La2Al3Ge",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.6709790583333333,
"spacegroup": 187
},
{
"id": "jvasp-101182",
"created_at": "2022-09-04T14:37:04.259012Z",
"updated_at": "2022-09-04T14:37:04.259036Z",
"structure_string": "K1 Rb1 Cl2\n1.0\n4.332745 0.000991 6.561409\n1.971643 3.858148 6.561409\n0.001618 0.000991 7.862872\nK Rb Cl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Rb\n0.254419 0.254419 0.254419 Cl\n0.745582 0.745581 0.745581 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Rb",
"Cl"
],
"chemical_system": "Cl-K-Rb",
"density": 2.470856447066702,
"density_atomic": 0.03044904173461343,
"volume": 131.3670241205961,
"volume_molar": 19.777767761913626,
"formula_full": "K1 Rb1 Cl2",
"formula_reduced": "KRbCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 166
}
]
}