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=updated_at&page=3435",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=3433",
"results": [
{
"id": "jvasp-46336",
"created_at": "2022-09-04T14:38:08.521540Z",
"updated_at": "2022-09-04T14:38:08.521568Z",
"structure_string": "V2 Cr4 O8\n1.0\n-4.192799 4.192799 -0.000000\n4.192799 0.000000 4.192799\n4.192799 4.192799 -0.000000\nV Cr O\n2 4 8\ndirect\n0.625000 0.250000 0.625000 V\n0.375000 0.750000 0.375000 V\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.781457 0.020971 0.239514 O\n0.760486 0.520971 0.218543 O\n0.239514 0.020971 0.239514 O\n0.239514 0.479029 0.239514 O\n0.760486 0.520971 0.760486 O\n0.760486 0.979029 0.760486 O\n0.239514 0.479029 0.781457 O\n0.218543 0.979029 0.760486 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Cr",
"O"
],
"chemical_system": "Cr-O-V",
"density": 4.932247075879428,
"density_atomic": 0.09496988468536136,
"volume": 147.41515214409813,
"volume_molar": 6.341105688346962,
"formula_full": "V2 Cr4 O8",
"formula_reduced": "VCr2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.558247571428572,
"spacegroup": 227
},
{
"id": "jvasp-40446",
"created_at": "2022-09-04T14:38:08.522788Z",
"updated_at": "2022-09-04T14:38:08.522809Z",
"structure_string": "Tc6 Ni2\n1.0\n2.682905 -4.646928 -0.000000\n2.682905 4.646928 0.000000\n-0.000000 -0.000000 4.323014\nTc Ni\n6 2\ndirect\n0.833588 0.667177 0.749999 Tc\n0.166410 0.833588 0.250000 Tc\n0.667177 0.833588 0.250000 Tc\n0.166410 0.332821 0.250000 Tc\n0.833588 0.166410 0.749999 Tc\n0.332821 0.166410 0.749999 Tc\n0.666666 0.333332 0.250000 Ni\n0.333332 0.666666 0.749999 Ni\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tc",
"Ni"
],
"chemical_system": "Ni-Tc",
"density": 10.866471613531987,
"density_atomic": 0.0742167805168437,
"volume": 107.79233408251086,
"volume_molar": 8.114257608672824,
"formula_full": "Tc6 Ni2",
"formula_reduced": "Tc3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 4.318389225,
"spacegroup": 194
},
{
"id": "jvasp-10198",
"created_at": "2022-09-04T14:38:08.525594Z",
"updated_at": "2022-09-04T14:38:08.525625Z",
"structure_string": "Li4 Ge4 O10\n1.0\n5.007285 0.001625 -0.000641\n-0.001757 5.548069 -2.187817\n0.000879 0.055061 8.268193\nLi Ge O\n4 4 10\ndirect\n0.605795 0.703472 0.110488 Li\n0.105794 0.592983 0.889511 Li\n0.105786 0.403220 0.110487 Li\n0.605787 0.292733 0.889512 Li\n0.100210 0.013659 0.708482 Ge\n0.100218 0.982546 0.291511 Ge\n0.600210 0.305178 0.291518 Ge\n0.600218 0.691034 0.708488 Ge\n0.498720 0.498128 0.499998 O\n0.955177 0.746476 0.731027 O\n0.455176 0.015449 0.268972 O\n0.455178 0.980778 0.731031 O\n0.955179 0.249745 0.268968 O\n0.989463 0.723554 0.131425 O\n0.989456 0.272669 0.868565 O\n0.489455 0.404104 0.131434 O\n0.489463 0.592130 0.868574 O\n-0.001281 0.998130 0.500001 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Ge",
"O"
],
"chemical_system": "Ge-Li-O",
"density": 3.448831877230714,
"density_atomic": 0.07815894834186571,
"volume": 230.29992575217815,
"volume_molar": 7.704992054984254,
"formula_full": "Li4 Ge4 O10",
"formula_reduced": "Li2Ge2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.7587466,
"spacegroup": 37
},
{
"id": "jvasp-38024",
"created_at": "2022-09-04T14:38:08.529955Z",
"updated_at": "2022-09-04T14:38:08.529985Z",
"structure_string": "Al8 As8\n1.0\n7.027953 -0.000000 -0.000000\n0.000000 7.027953 -0.000000\n-0.000000 0.000000 7.027953\nAl As\n8 8\ndirect\n0.342764 0.342764 0.342764 Al\n0.157236 0.657236 0.842764 Al\n0.842764 0.157236 0.657236 Al\n0.657236 0.842764 0.157236 Al\n0.657236 0.657236 0.657236 Al\n0.842764 0.342764 0.157236 Al\n0.157236 0.842764 0.342764 Al\n0.342764 0.157236 0.842764 Al\n0.142598 0.142598 0.142598 As\n0.357402 0.857402 0.642598 As\n0.642598 0.357402 0.857402 As\n0.857402 0.642598 0.357402 As\n0.857402 0.857402 0.857402 As\n0.642598 0.142598 0.357402 As\n0.357402 0.642598 0.142598 As\n0.142598 0.357402 0.642598 As\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Al",
"As"
],
"chemical_system": "Al-As",
"density": 3.8997799266774518,
"density_atomic": 0.04609283675113421,
"volume": 347.1255216160304,
"volume_molar": 13.065242203500986,
"formula_full": "Al8 As8",
"formula_reduced": "AlAs",
"formula_anonymous": "AB",
"energy_above_hull": 1.1199322749999998,
"spacegroup": 205
},
{
"id": "jvasp-34672",
"created_at": "2022-09-04T14:38:08.532358Z",
"updated_at": "2022-09-04T14:38:08.532385Z",
"structure_string": "Ca4 Bi2 As2 O12\n1.0\n5.614676 0.000000 0.000000\n0.000000 7.117716 -2.100274\n-0.000000 0.051908 7.420939\nCa Bi As O\n4 2 2 12\ndirect\n0.763387 0.698224 0.907919 Ca\n0.763387 0.092082 0.301777 Ca\n0.263387 0.907919 0.698224 Ca\n0.263387 0.301777 0.092082 Ca\n0.251696 0.407346 0.592655 Bi\n0.751697 0.592655 0.407346 Bi\n0.803655 0.182281 0.817720 As\n0.303655 0.817720 0.182281 As\n0.423910 0.597815 0.086900 O\n0.423348 0.952769 0.047232 O\n0.011608 0.658334 0.650802 O\n0.497492 0.188826 0.811174 O\n0.011608 0.349199 0.341666 O\n0.923910 0.402186 0.913101 O\n0.511608 0.341666 0.349199 O\n0.423910 0.913101 0.402186 O\n0.923349 0.047232 0.952769 O\n0.511608 0.650802 0.658334 O\n0.997493 0.811175 0.188827 O\n0.923910 0.086900 0.597815 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Bi",
"As",
"O"
],
"chemical_system": "As-Bi-Ca-O",
"density": 5.141248579373234,
"density_atomic": 0.0672992642562167,
"volume": 297.18006906966326,
"volume_molar": 8.948301035020172,
"formula_full": "Ca4 Bi2 As2 O12",
"formula_reduced": "Ca2BiAsO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.784665789,
"spacegroup": 36
},
{
"id": "jvasp-65068",
"created_at": "2022-09-04T14:38:08.532377Z",
"updated_at": "2022-09-04T14:38:08.532404Z",
"structure_string": "Ca4 Mg1 Be1\n1.0\n0.000000 4.683459 4.683459\n4.683459 -0.000000 4.683459\n4.683459 4.683459 -0.000000\nCa Mg Be\n4 1 1\ndirect\n0.124289 0.625238 0.625238 Ca\n0.625238 0.625238 0.625238 Ca\n0.625238 0.124289 0.625238 Ca\n0.625238 0.625238 0.124289 Ca\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Be\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Be"
],
"chemical_system": "Be-Ca-Mg",
"density": 1.5649113648140869,
"density_atomic": 0.029202570878260226,
"volume": 205.46136246061417,
"volume_molar": 20.621954091319978,
"formula_full": "Ca4 Mg1 Be1",
"formula_reduced": "Ca4MgBe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-55967",
"created_at": "2022-09-04T14:38:08.535828Z",
"updated_at": "2022-09-04T14:38:08.535863Z",
"structure_string": "Pb7 Cl2 F12\n1.0\n5.144743 -8.910955 -0.000000\n5.144743 8.910955 0.000000\n0.000000 0.000000 3.974747\nPb Cl F\n7 2 12\ndirect\n0.109984 0.413515 0.500000 Pb\n0.586485 0.696469 0.500000 Pb\n0.303531 0.890015 0.500000 Pb\n0.712807 0.113954 0.000000 Pb\n0.401147 0.287193 0.000000 Pb\n0.886045 0.598852 0.000000 Pb\n0.000000 0.000000 0.500000 Pb\n0.333333 0.666667 0.000000 Cl\n0.666667 0.333333 0.500000 Cl\n0.277336 0.114393 0.500000 F\n0.960175 0.388428 0.000000 F\n0.083038 0.871900 0.000000 F\n0.428252 0.039825 0.000000 F\n0.568665 0.947570 0.500000 F\n0.378906 0.431335 0.500000 F\n0.052429 0.621094 0.500000 F\n0.788862 0.916961 0.000000 F\n0.611572 0.571747 0.000000 F\n0.128099 0.211137 0.000000 F\n0.885606 0.162943 0.500000 F\n0.837056 0.722663 0.500000 F\n",
"nsites": 21,
"nelements": 3,
"elements": [
"Pb",
"Cl",
"F"
],
"chemical_system": "Cl-F-Pb",
"density": 7.970447484697604,
"density_atomic": 0.05762247038936576,
"volume": 364.44116085442175,
"volume_molar": 10.451028425729188,
"formula_full": "Pb7 Cl2 F12",
"formula_reduced": "Pb7(ClF6)2",
"formula_anonymous": "A2B7C12",
"energy_above_hull": 0.0641608059523811,
"spacegroup": 174
},
{
"id": "jvasp-18178",
"created_at": "2022-09-04T14:38:08.538559Z",
"updated_at": "2022-09-04T14:38:08.538587Z",
"structure_string": "Mn1 Cu2 Sn1\n1.0\n3.813323 -0.000000 2.201624\n1.271108 3.595236 2.201624\n-0.000000 -0.000000 4.403247\nMn Cu Sn\n1 2 1\ndirect\n0.500000 0.500001 0.499999 Mn\n0.250000 0.250000 0.250000 Cu\n0.749999 0.750001 0.749999 Cu\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Cu",
"Sn"
],
"chemical_system": "Cu-Mn-Sn",
"density": 8.272491189168447,
"density_atomic": 0.06626068888730563,
"volume": 60.367618676634805,
"volume_molar": 9.088557425417493,
"formula_full": "Mn1 Cu2 Sn1",
"formula_reduced": "MnCu2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9892774603448274,
"spacegroup": 225
},
{
"id": "jvasp-64137",
"created_at": "2022-09-04T14:38:08.544561Z",
"updated_at": "2022-09-04T14:38:08.544597Z",
"structure_string": "Ba4 Sn1 Pb1\n1.0\n-0.000000 5.002887 5.002887\n5.002887 0.000000 5.002887\n5.002887 5.002887 0.000000\nBa Sn Pb\n4 1 1\ndirect\n0.124428 0.625192 0.625192 Ba\n0.625192 0.625192 0.625192 Ba\n0.625192 0.124428 0.625192 Ba\n0.625192 0.625192 0.124428 Ba\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Pb"
],
"chemical_system": "Ba-Pb-Sn",
"density": 5.80327648225012,
"density_atomic": 0.023958475162109458,
"volume": 250.433300091195,
"volume_molar": 25.13574306900829,
"formula_full": "Ba4 Sn1 Pb1",
"formula_reduced": "Ba4SnPb",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0254203233333333,
"spacegroup": 216
},
{
"id": "jvasp-17947",
"created_at": "2022-09-04T14:38:08.546382Z",
"updated_at": "2022-09-04T14:38:08.546412Z",
"structure_string": "Ce2 Ge4\n1.0\n3.901683 0.000000 -1.137935\n-0.331882 3.887542 -1.137935\n0.417924 0.455123 8.690847\nCe Ge\n2 4\ndirect\n0.874999 0.624999 0.250001 Ce\n0.124999 0.374999 0.750000 Ce\n0.704411 0.954411 0.908825 Ge\n0.454411 0.204412 0.408824 Ge\n0.545587 0.795587 0.591177 Ge\n0.295588 0.045588 0.091176 Ge\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Ge"
],
"chemical_system": "Ce-Ge",
"density": 6.976271342493449,
"density_atomic": 0.04416188876399971,
"volume": 135.86375419909882,
"volume_molar": 13.636510866150235,
"formula_full": "Ce2 Ge4",
"formula_reduced": "CeGe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9298591333333333,
"spacegroup": 141
},
{
"id": "jvasp-34410",
"created_at": "2022-09-04T14:38:08.547384Z",
"updated_at": "2022-09-04T14:38:08.547411Z",
"structure_string": "Na8 Zn8 O12\n1.0\n6.232672 -0.000000 0.000000\n0.000000 6.232672 0.000000\n0.000000 -0.000000 9.415318\nNa Zn O\n8 8 12\ndirect\n0.746394 0.529728 0.644850 Na\n0.970272 0.246394 0.394850 Na\n0.470272 0.253606 0.855150 Na\n0.253606 0.470272 0.144850 Na\n0.029728 0.753605 0.894850 Na\n0.753605 0.029728 0.105150 Na\n0.529728 0.746394 0.355150 Na\n0.246394 0.970272 0.605150 Na\n0.745027 0.541514 0.114840 Zn\n0.958486 0.245027 0.864840 Zn\n0.245027 0.958486 0.135160 Zn\n0.541514 0.745027 0.885160 Zn\n0.458486 0.254973 0.385160 Zn\n0.041514 0.754973 0.364840 Zn\n0.254973 0.458486 0.614840 Zn\n0.754973 0.041514 0.635160 Zn\n0.742624 0.986933 0.844675 O\n0.317921 0.682078 0.750000 O\n0.242624 0.513067 0.405325 O\n0.486933 0.757376 0.094675 O\n0.757376 0.486933 0.905325 O\n0.682078 0.317921 0.250000 O\n0.986933 0.742624 0.155325 O\n0.817921 0.817921 0.500000 O\n0.513067 0.242624 0.594675 O\n0.013067 0.257376 0.655325 O\n0.257376 0.013067 0.344675 O\n0.182079 0.182079 0.000000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Zn",
"O"
],
"chemical_system": "Na-O-Zn",
"density": 4.08238185840092,
"density_atomic": 0.07655516446770344,
"volume": 365.7493285356659,
"volume_molar": 7.866406926133088,
"formula_full": "Na8 Zn8 O12",
"formula_reduced": "Na2Zn2O3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 0.2083056142857144,
"spacegroup": 96
},
{
"id": "jvasp-37463",
"created_at": "2022-09-04T14:38:08.553148Z",
"updated_at": "2022-09-04T14:38:08.553173Z",
"structure_string": "Y1 Nb1 Ru2\n1.0\n-0.000000 3.276329 3.276329\n3.276329 -0.000000 3.276329\n3.276329 3.276329 -0.000000\nY Nb Ru\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Y\n0.250000 0.250000 0.250000 Nb\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Nb",
"Ru"
],
"chemical_system": "Nb-Ru-Y",
"density": 9.064289719016202,
"density_atomic": 0.056867937551710865,
"volume": 70.33840459508032,
"volume_molar": 10.589694332635112,
"formula_full": "Y1 Nb1 Ru2",
"formula_reduced": "YNbRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.2653064625,
"spacegroup": 225
}
]
}