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=-nelements&page=4570",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4568",
"results": [
{
"id": "jvasp-58505",
"created_at": "2022-09-04T14:37:14.289015Z",
"updated_at": "2022-09-04T14:37:14.289037Z",
"structure_string": "Mo4 S8\n1.0\n5.882572 0.015668 3.370716\n1.960780 5.546193 3.370716\n0.022096 0.015668 6.779817\nMo S\n4 8\ndirect\n0.396140 0.396139 0.828747 Mo\n0.828746 0.396139 0.396140 Mo\n0.396139 0.828746 0.396140 Mo\n0.396176 0.396176 0.396176 Mo\n0.639862 0.639862 0.639863 S\n0.097558 0.639887 0.639887 S\n0.639887 0.097558 0.639887 S\n0.134702 0.613110 0.134702 S\n0.134668 0.134668 0.134668 S\n0.134702 0.134702 0.613110 S\n0.613110 0.134702 0.134702 S\n0.639887 0.639887 0.097559 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mo",
"S"
],
"chemical_system": "Mo-S",
"density": 4.824654414372296,
"density_atomic": 0.05445382897184863,
"volume": 220.37017830653787,
"volume_molar": 11.059168608902247,
"formula_full": "Mo4 S8",
"formula_reduced": "MoS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.6528852999999994,
"spacegroup": 216
},
{
"id": "jvasp-36360",
"created_at": "2022-09-04T14:37:13.813276Z",
"updated_at": "2022-09-04T14:37:13.813307Z",
"structure_string": "Pr1 As1\n1.0\n3.894983 -0.000000 -0.000000\n-0.000000 3.894983 -0.000000\n0.000000 0.000000 3.313410\nPr As\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"As"
],
"chemical_system": "As-Pr",
"density": 7.129730062577118,
"density_atomic": 0.03978722812823642,
"volume": 50.26738715132127,
"volume_molar": 15.135864053133607,
"formula_full": "Pr1 As1",
"formula_reduced": "PrAs",
"formula_anonymous": "AB",
"energy_above_hull": 0.7696058000000001,
"spacegroup": 123
},
{
"id": "jvasp-36420",
"created_at": "2022-09-04T14:37:27.302438Z",
"updated_at": "2022-09-04T14:37:27.302489Z",
"structure_string": "Ta1 C1\n1.0\n2.800141 0.000000 0.000000\n-0.000000 2.800141 0.000000\n-0.000000 -0.000000 2.800141\nTa C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ta",
"C"
],
"chemical_system": "C-Ta",
"density": 14.593971374329142,
"density_atomic": 0.09109410930987634,
"volume": 21.955316487003202,
"volume_molar": 6.6109003157541,
"formula_full": "Ta1 C1",
"formula_reduced": "TaC",
"formula_anonymous": "AB",
"energy_above_hull": 4.4381846,
"spacegroup": 221
},
{
"id": "jvasp-40636",
"created_at": "2022-09-04T14:37:26.973476Z",
"updated_at": "2022-09-04T14:37:26.973501Z",
"structure_string": "Si4 O10\n1.0\n-3.008464 6.344778 2.516483\n3.008464 -6.344778 2.516483\n3.008464 6.344778 -2.516483\nSi O\n4 10\ndirect\n0.566606 0.052919 0.719018 Si\n0.333900 0.847586 0.280981 Si\n0.833901 0.052919 0.986313 Si\n0.066605 0.847586 0.013686 Si\n0.497559 0.997558 0.499999 O\n0.997558 0.997558 0.000000 O\n0.278585 0.828673 0.817065 O\n0.011607 0.461518 0.182934 O\n0.511607 0.828673 0.050088 O\n0.778586 0.461518 0.949911 O\n0.722806 0.918625 0.580793 O\n0.337834 0.142013 0.419206 O\n0.837833 0.918625 0.695820 O\n0.222806 0.142013 0.304180 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.353633894357978,
"density_atomic": 0.07286396385318314,
"volume": 192.1388744127238,
"volume_molar": 8.26490962272418,
"formula_full": "Si4 O10",
"formula_reduced": "Si2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.6731521,
"spacegroup": 46
},
{
"id": "jvasp-14724",
"created_at": "2022-09-04T14:37:15.500715Z",
"updated_at": "2022-09-04T14:37:15.500748Z",
"structure_string": "Co1 N1\n1.0\n2.606911 0.000000 1.505101\n0.868971 2.457819 1.505101\n-0.000000 -0.000000 3.010202\nCo N\n1 1\ndirect\n0.000000 0.000000 0.000000 Co\n0.250000 0.250000 0.250000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Co",
"N"
],
"chemical_system": "Co-N",
"density": 6.279751950823712,
"density_atomic": 0.10369510457566174,
"volume": 19.28731359290629,
"volume_molar": 5.807545866937151,
"formula_full": "Co1 N1",
"formula_reduced": "CoN",
"formula_anonymous": "AB",
"energy_above_hull": 2.799427075,
"spacegroup": 216
},
{
"id": "jvasp-18999",
"created_at": "2022-09-04T14:37:07.419307Z",
"updated_at": "2022-09-04T14:37:07.419324Z",
"structure_string": "Tm8 S12\n1.0\n0.000000 10.863336 0.009604\n3.866278 0.000000 0.000000\n0.000000 -3.602043 -10.527484\nTm S\n8 12\ndirect\n0.817710 0.250000 0.996921 Tm\n0.182291 0.750000 0.003079 Tm\n0.456065 0.250000 0.809154 Tm\n0.543935 0.750000 0.190846 Tm\n0.067726 0.250000 0.668181 Tm\n0.932275 0.750000 0.331819 Tm\n0.339047 0.250000 0.416679 Tm\n0.660954 0.750000 0.583321 Tm\n0.246003 0.750000 0.776762 S\n0.753998 0.250000 0.223238 S\n0.418490 0.750000 0.598884 S\n0.581511 0.250000 0.401116 S\n0.897173 0.750000 0.562991 S\n0.978719 0.750000 0.114279 S\n0.308016 0.750000 0.250536 S\n0.691984 0.250000 0.749464 S\n0.389310 0.250000 0.036940 S\n0.021282 0.250000 0.885721 S\n0.102827 0.250000 0.437009 S\n0.610691 0.750000 0.963060 S\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Tm",
"S"
],
"chemical_system": "S-Tm",
"density": 6.522480454654464,
"density_atomic": 0.04524603272933257,
"volume": 442.02770482978036,
"volume_molar": 13.309765291523346,
"formula_full": "Tm8 S12",
"formula_reduced": "Tm2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3402137,
"spacegroup": 11
},
{
"id": "jvasp-17994",
"created_at": "2022-09-04T14:37:27.275469Z",
"updated_at": "2022-09-04T14:37:27.275495Z",
"structure_string": "Ca4 In4\n1.0\n6.173487 0.349894 -2.406114\n-3.393111 5.406908 -1.809941\n0.219576 -0.349894 6.622168\nCa In\n4 4\ndirect\n0.500001 0.750000 0.250001 Ca\n0.500001 0.250000 0.750001 Ca\n0.000001 0.749998 0.749999 Ca\n0.000000 0.250003 0.250003 Ca\n0.500038 0.750019 0.750020 In\n0.000001 0.750019 0.249982 In\n0.000001 0.249982 0.750019 In\n0.499963 0.249981 0.249982 In\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ca",
"In"
],
"chemical_system": "Ca-In",
"density": 4.575527624839189,
"density_atomic": 0.035578028377198,
"volume": 224.85787900285138,
"volume_molar": 16.926572479377743,
"formula_full": "Ca4 In4",
"formula_reduced": "CaIn",
"formula_anonymous": "AB",
"energy_above_hull": 0.0012488461538461,
"spacegroup": 221
},
{
"id": "jvasp-10926",
"created_at": "2022-09-04T14:37:19.725513Z",
"updated_at": "2022-09-04T14:37:19.725523Z",
"structure_string": "Cr4 O10\n1.0\n3.563138 0.000000 0.000000\n0.000000 4.551040 0.000000\n0.000000 0.000000 11.086914\nCr O\n4 10\ndirect\n0.000000 0.880889 0.849112 Cr\n0.500000 0.119126 0.650898 Cr\n0.500000 0.119111 0.349112 Cr\n0.000000 0.880874 0.150898 Cr\n0.500000 0.993603 0.817655 O\n0.000000 0.006411 0.682354 O\n0.000000 0.006397 0.317655 O\n0.500000 0.993589 0.182354 O\n0.000000 0.534917 0.146871 O\n0.500000 0.465072 0.353135 O\n0.500000 0.465083 0.646871 O\n0.500000 0.010887 0.500005 O\n0.000000 -0.010887 0.000005 O\n0.000000 0.534928 0.853134 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 3.3987361430419254,
"density_atomic": 0.07787069690286068,
"volume": 179.7852151941598,
"volume_molar": 7.733513374758009,
"formula_full": "Cr4 O10",
"formula_reduced": "Cr2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.2606403285714283,
"spacegroup": 59
},
{
"id": "jvasp-80494",
"created_at": "2022-09-04T14:37:19.732985Z",
"updated_at": "2022-09-04T14:37:19.732996Z",
"structure_string": "Y1 Mg3\n1.0\n3.313688 0.000000 0.000000\n-1.656843 2.869737 0.000000\n0.000000 -0.000000 10.747440\nY Mg\n1 3\ndirect\n0.666668 0.333333 0.500000 Y\n0.666668 0.333333 0.000000 Mg\n0.333334 0.666668 0.238371 Mg\n0.333334 0.666668 0.761629 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.629207327932926,
"density_atomic": 0.03913823619516833,
"volume": 102.20184629816826,
"volume_molar": 15.386847608486356,
"formula_full": "Y1 Mg3",
"formula_reduced": "YMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4758675642857143,
"spacegroup": 187
},
{
"id": "jvasp-10941",
"created_at": "2022-09-04T14:37:12.924490Z",
"updated_at": "2022-09-04T14:37:12.924515Z",
"structure_string": "Ni4 O8\n1.0\n2.852894 0.000417 0.000295\n1.425435 6.733248 -0.001817\n1.425557 0.023932 6.720282\nNi O\n4 8\ndirect\n0.830190 0.816135 0.518413 Ni\n0.645828 0.518426 0.184866 Ni\n0.348245 0.481212 0.817266 Ni\n0.163845 0.183503 0.483722 Ni\n0.541556 0.280007 0.631821 O\n0.824184 0.628097 0.718494 O\n0.169884 0.371541 0.283640 O\n0.452491 0.719628 0.370316 O\n0.198604 0.951692 0.646047 O\n0.151329 0.644904 0.047390 O\n0.795440 0.047947 0.356088 O\n0.842746 0.354735 0.954746 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ni",
"O"
],
"chemical_system": "Ni-O",
"density": 4.666634633316828,
"density_atomic": 0.09296212016150263,
"volume": 129.08483562070722,
"volume_molar": 6.478058750744674,
"formula_full": "Ni4 O8",
"formula_reduced": "NiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4740331333333336,
"spacegroup": 87
},
{
"id": "jvasp-34537",
"created_at": "2022-09-04T14:37:08.405342Z",
"updated_at": "2022-09-04T14:37:08.405361Z",
"structure_string": "Zn8 S8\n1.0\n1.919411 -3.324518 0.000000\n1.919411 3.324518 -0.000000\n-0.000000 -0.000000 25.156879\nZn S\n8 8\ndirect\n0.666667 0.333333 0.125092 Zn\n0.000000 0.000000 0.000372 Zn\n0.333333 0.666667 0.624835 Zn\n0.333333 0.666667 0.875338 Zn\n0.000000 0.000000 0.750101 Zn\n0.666667 0.333333 0.375141 Zn\n0.000000 0.000000 0.499857 Zn\n0.333333 0.666667 0.250075 Zn\n0.333333 0.666667 0.343791 S\n0.333333 0.666667 0.969024 S\n0.666667 0.333333 0.218606 S\n0.000000 0.000000 0.593371 S\n0.000000 0.000000 0.093859 S\n0.000000 0.000000 0.843774 S\n0.666667 0.333333 0.468624 S\n0.333333 0.666667 0.718540 S\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zn",
"S"
],
"chemical_system": "S-Zn",
"density": 4.033150684577652,
"density_atomic": 0.04983524044814097,
"volume": 321.05794727026057,
"volume_molar": 12.084100941113544,
"formula_full": "Zn8 S8",
"formula_reduced": "ZnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.00095,
"spacegroup": 156
},
{
"id": "jvasp-53025",
"created_at": "2022-09-04T14:37:07.815247Z",
"updated_at": "2022-09-04T14:37:07.815273Z",
"structure_string": "Fe2 O2\n1.0\n3.036691 0.000000 0.000000\n0.000000 3.036691 0.000000\n0.000000 -0.000000 4.291361\nFe O\n2 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 6.029423102469391,
"density_atomic": 0.10107965168395742,
"volume": 39.57275211539781,
"volume_molar": 5.957817087487835,
"formula_full": "Fe2 O2",
"formula_reduced": "FeO",
"formula_anonymous": "AB",
"energy_above_hull": 1.4425795,
"spacegroup": 225
}
]
}