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=877",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=875",
"results": [
{
"id": "jvasp-109599",
"created_at": "2022-09-04T14:38:20.766162Z",
"updated_at": "2022-09-04T14:38:20.766177Z",
"structure_string": "Sr1 Mg1 Hg2\n1.0\n4.589699 0.000000 2.649864\n1.529900 4.327210 2.649864\n0.000000 -0.000000 5.299728\nSr Mg Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.499999 Mg\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.749999 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg-Sr",
"density": 8.09486455903903,
"density_atomic": 0.03800268079594998,
"volume": 105.25573239102354,
"volume_molar": 15.846620906390879,
"formula_full": "Sr1 Mg1 Hg2",
"formula_reduced": "SrMgHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-30501",
"created_at": "2022-09-04T14:38:00.328575Z",
"updated_at": "2022-09-04T14:38:00.328598Z",
"structure_string": "C2\n1.0\n2.465485 0.000000 0.000000\n-1.232743 2.135173 0.000000\n0.000000 0.000000 9.997132\nC\n2\ndirect\n0.000000 0.000000 0.250000 C\n0.333333 0.666666 0.250000 C\n",
"nsites": 2,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 0.7579430105608811,
"density_atomic": 0.038003109720775356,
"volume": 52.627272207322804,
"volume_molar": 15.846442052366694,
"formula_full": "C2",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.06996,
"spacegroup": 191
},
{
"id": "jvasp-69144",
"created_at": "2022-09-04T14:36:22.295518Z",
"updated_at": "2022-09-04T14:36:22.295546Z",
"structure_string": "Ba1 Cr2 Cd1\n1.0\n4.931093 0.000000 0.000000\n0.000000 4.931093 0.000000\n0.000000 0.000000 4.328654\nBa Cr Cd\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 Cr\n0.000000 0.000000 0.500000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"Cd"
],
"chemical_system": "Ba-Cd-Cr",
"density": 5.580613911758899,
"density_atomic": 0.0380032493866119,
"volume": 105.25415759340709,
"volume_molar": 15.846383815068009,
"formula_full": "Ba1 Cr2 Cd1",
"formula_reduced": "BaCr2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.08467013,
"spacegroup": 123
},
{
"id": "jvasp-92906",
"created_at": "2022-09-04T14:36:00.553173Z",
"updated_at": "2022-09-04T14:36:00.553207Z",
"structure_string": "Ba1 Mg6 C1\n1.0\n10.330956 2.657858 0.000000\n-2.863706 4.960084 0.000000\n0.000000 0.000000 3.576796\nBa Mg C\n1 6 1\ndirect\n0.073939 0.286969 0.250000 Ba\n0.585514 0.290469 0.250000 Mg\n0.585514 0.795044 0.250000 Mg\n0.356986 0.159148 0.750001 Mg\n0.356986 0.697839 0.750001 Mg\n0.782363 0.141183 0.750001 Mg\n0.847867 0.673933 0.750001 Mg\n0.410831 0.955415 0.250000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"C"
],
"chemical_system": "Ba-C-Mg",
"density": 2.3283579073983125,
"density_atomic": 0.03800334267701319,
"volume": 210.50779843213377,
"volume_molar": 15.84634491545021,
"formula_full": "Ba1 Mg6 C1",
"formula_reduced": "BaMg6C",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.1319700337499999,
"spacegroup": 38
},
{
"id": "jvasp-116160",
"created_at": "2022-09-04T14:38:50.806438Z",
"updated_at": "2022-09-04T14:38:50.806464Z",
"structure_string": "Hf1 Cl2\n1.0\n5.728971 0.701729 1.159354\n0.586993 -4.897408 0.165277\n-0.593252 -5.125349 -2.845594\nHf Cl\n1 2\ndirect\n0.270032 0.892652 0.368880 Hf\n0.770031 0.392702 0.868796 Cl\n0.270146 0.392405 0.369125 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"Cl"
],
"chemical_system": "Cl-Hf",
"density": 5.246216532510008,
"density_atomic": 0.03800396288689362,
"volume": 78.93913613505306,
"volume_molar": 15.84608630926973,
"formula_full": "Hf1 Cl2",
"formula_reduced": "HfCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.284783711666667,
"spacegroup": 123
},
{
"id": "jvasp-78490",
"created_at": "2022-09-04T14:37:09.333580Z",
"updated_at": "2022-09-04T14:37:09.333600Z",
"structure_string": "Sm1 Hg2\n1.0\n0.419978 0.242474 -4.306519\n-1.622688 -4.076566 0.648254\n-2.719064 4.709557 -0.000000\nSm Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.337707 0.326079 0.663039 Hg\n0.662294 0.673921 0.336959 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sm",
"Hg"
],
"chemical_system": "Hg-Sm",
"density": 11.602365073395422,
"density_atomic": 0.03800508157796765,
"volume": 78.93681253769927,
"volume_molar": 15.845619874925262,
"formula_full": "Sm1 Hg2",
"formula_reduced": "SmHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0099999999999999,
"spacegroup": 12
},
{
"id": "jvasp-15332",
"created_at": "2022-09-04T14:36:56.437397Z",
"updated_at": "2022-09-04T14:36:56.437419Z",
"structure_string": "Dy6 Fe1 Sb2\n1.0\n4.088619 -7.081696 0.000000\n4.088619 7.081696 0.000000\n-0.000000 -0.000000 4.089355\nDy Fe Sb\n6 1 2\ndirect\n0.233773 0.233773 0.000000 Dy\n0.766227 -0.000000 0.000000 Dy\n-0.000000 0.766227 0.000000 Dy\n0.601336 0.601336 0.499999 Dy\n0.398665 -0.000000 0.499999 Dy\n-0.000000 0.398665 0.499999 Dy\n0.000000 0.000000 0.499999 Fe\n0.333333 0.666667 0.000000 Sb\n0.666667 0.333333 0.000000 Sb\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Dy",
"Fe",
"Sb"
],
"chemical_system": "Dy-Fe-Sb",
"density": 8.936021423026858,
"density_atomic": 0.038005266133483095,
"volume": 236.8092876495053,
"volume_molar": 15.845542927785006,
"formula_full": "Dy6 Fe1 Sb2",
"formula_reduced": "Dy6FeSb2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.922604077777778,
"spacegroup": 189
},
{
"id": "jvasp-18277",
"created_at": "2022-09-04T14:38:11.036900Z",
"updated_at": "2022-09-04T14:38:11.036926Z",
"structure_string": "Y1 In1\n1.0\n3.747301 -0.000000 0.000000\n0.000000 3.747301 0.000000\n-0.000000 -0.000000 3.747301\nY In\n1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"In"
],
"chemical_system": "In-Y",
"density": 6.428878757817939,
"density_atomic": 0.038007933604173365,
"volume": 52.620592869600124,
"volume_molar": 15.844430856769215,
"formula_full": "Y1 In1",
"formula_reduced": "YIn",
"formula_anonymous": "AB",
"energy_above_hull": 0.5440127099999998,
"spacegroup": 221
},
{
"id": "jvasp-113732",
"created_at": "2022-09-04T14:38:49.654827Z",
"updated_at": "2022-09-04T14:38:49.654839Z",
"structure_string": "Sr1 Ti1 O1\n1.0\n3.276171 -0.000000 0.000000\n0.000000 3.276171 0.000000\n0.000000 -0.000000 7.353689\nSr Ti O\n1 1 1\ndirect\n0.000000 0.000000 0.299243 Sr\n0.000000 0.000000 0.760200 Ti\n0.000000 0.000000 -0.007709 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ti",
"O"
],
"chemical_system": "O-Sr-Ti",
"density": 3.187016853345424,
"density_atomic": 0.038008687450433155,
"volume": 78.92932382661931,
"volume_molar": 15.844116605850777,
"formula_full": "Sr1 Ti1 O1",
"formula_reduced": "SrTiO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4172893811111111,
"spacegroup": 99
},
{
"id": "jvasp-28387",
"created_at": "2022-09-04T14:36:43.755059Z",
"updated_at": "2022-09-04T14:36:43.755082Z",
"structure_string": "Te4 W2\n1.0\n3.571743 0.000000 0.000000\n-1.785872 3.093297 0.000000\n0.000000 -0.000000 14.287470\nTe W\n4 2\ndirect\n0.333356 0.666713 0.877176 Te\n0.666644 0.333288 0.122824 Te\n0.666644 0.333288 0.377176 Te\n0.333356 0.666713 0.622824 Te\n0.333323 0.666647 0.250000 W\n0.666677 0.333354 0.750000 W\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Te",
"W"
],
"chemical_system": "Te-W",
"density": 9.236895464766361,
"density_atomic": 0.038009669752267515,
"volume": 157.85456803770472,
"volume_molar": 15.843707138867583,
"formula_full": "Te4 W2",
"formula_reduced": "Te2W",
"formula_anonymous": "AB2",
"energy_above_hull": 2.920125177777778,
"spacegroup": 194
},
{
"id": "jvasp-20485",
"created_at": "2022-09-04T14:37:26.898514Z",
"updated_at": "2022-09-04T14:37:26.898535Z",
"structure_string": "Sm2 S2\n1.0\n3.872139 0.049331 -0.667303\n-0.164377 3.868963 -0.667303\n-0.728898 -0.770286 7.283095\nSm S\n2 2\ndirect\n0.344679 0.341677 0.686357 Sm\n0.658322 0.655320 0.313643 Sm\n0.138253 0.135254 0.273507 S\n0.864745 0.861746 0.726493 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"S"
],
"chemical_system": "S-Sm",
"density": 5.75705969550369,
"density_atomic": 0.03800994804662421,
"volume": 105.2356081911365,
"volume_molar": 15.843591137280827,
"formula_full": "Sm2 S2",
"formula_reduced": "SmS",
"formula_anonymous": "AB",
"energy_above_hull": 0.2048944374999997,
"spacegroup": 139
},
{
"id": "jvasp-14298",
"created_at": "2022-09-04T14:36:58.490851Z",
"updated_at": "2022-09-04T14:36:58.490886Z",
"structure_string": "Sm2 S2\n1.0\n3.872137 0.049448 -0.667324\n-0.164260 3.868967 -0.667324\n-0.728967 -0.770359 7.283049\nSm S\n2 2\ndirect\n0.344680 0.341689 0.686369 Sm\n0.658312 0.655320 0.313632 Sm\n0.138255 0.135247 0.273502 S\n0.864753 0.861746 0.726499 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"S"
],
"chemical_system": "S-Sm",
"density": 5.757109766253015,
"density_atomic": 0.0380102786297137,
"volume": 105.23469293574418,
"volume_molar": 15.843453342360727,
"formula_full": "Sm2 S2",
"formula_reduced": "SmS",
"formula_anonymous": "AB",
"energy_above_hull": 0.2048944374999997,
"spacegroup": 139
}
]
}