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=-energy_above_hull&page=179",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=177",
"results": [
{
"id": "jvasp-109540",
"created_at": "2022-09-04T14:38:18.631755Z",
"updated_at": "2022-09-04T14:38:18.631791Z",
"structure_string": "Hf2 Mo1 Pt1\n1.0\n4.038859 -0.000000 2.331836\n1.346286 3.807873 2.331836\n-0.000000 -0.000000 4.663673\nHf Mo Pt\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Hf\n0.750001 0.749999 0.750000 Hf\n0.500001 0.500000 0.500000 Mo\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Mo",
"Pt"
],
"chemical_system": "Hf-Mo-Pt",
"density": 15.002289619731373,
"density_atomic": 0.055768729726070096,
"volume": 71.72478232241549,
"volume_molar": 10.798418378148645,
"formula_full": "Hf2 Mo1 Pt1",
"formula_reduced": "Hf2MoPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.718768325,
"spacegroup": 225
},
{
"id": "jvasp-40445",
"created_at": "2022-09-04T14:38:02.034598Z",
"updated_at": "2022-09-04T14:38:02.034619Z",
"structure_string": "Tc2 Ru6\n1.0\n2.733323 -4.734254 0.000000\n2.733323 4.734254 0.000000\n-0.000000 -0.000000 4.313844\nTc Ru\n2 6\ndirect\n0.666666 0.333333 0.250000 Tc\n0.333333 0.666666 0.749999 Tc\n0.832668 0.665335 0.749999 Ru\n0.832668 0.167331 0.749999 Ru\n0.334664 0.167331 0.749999 Ru\n0.167331 0.334664 0.250000 Ru\n0.167331 0.832668 0.250000 Ru\n0.665335 0.832668 0.250000 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tc",
"Ru"
],
"chemical_system": "Ru-Tc",
"density": 11.93476577346123,
"density_atomic": 0.07165607980882982,
"volume": 111.6443994891024,
"volume_molar": 8.404228609863083,
"formula_full": "Tc2 Ru6",
"formula_reduced": "TcRu3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.7171632500000005,
"spacegroup": 194
},
{
"id": "jvasp-51132",
"created_at": "2022-09-04T14:37:03.154065Z",
"updated_at": "2022-09-04T14:37:03.154093Z",
"structure_string": "Li1 Pd1 W2\n1.0\n-0.000000 3.094240 3.094240\n3.094240 -0.000000 3.094240\n3.094240 3.094240 0.000000\nLi Pd W\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Pd\n0.750000 0.750000 0.750000 W\n0.250000 0.250000 0.250000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Pd",
"W"
],
"chemical_system": "Li-Pd-W",
"density": 13.481530770384088,
"density_atomic": 0.06750998437769831,
"volume": 59.250495121154046,
"volume_molar": 8.920370542982074,
"formula_full": "Li1 Pd1 W2",
"formula_reduced": "LiPdW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.717068925,
"spacegroup": 225
},
{
"id": "jvasp-109097",
"created_at": "2022-09-04T14:38:17.590967Z",
"updated_at": "2022-09-04T14:38:17.590991Z",
"structure_string": "Sm2 Si2 Os4 C2\n1.0\n5.916563 -0.004705 0.000000\n-4.604300 3.715664 0.000000\n0.000000 -0.000000 7.176065\nSm Si Os C\n2 2 4 2\ndirect\n0.548555 0.451443 0.250000 Sm\n0.451443 0.548555 0.749999 Sm\n0.270120 0.729877 0.250000 Si\n0.729877 0.270120 0.749999 Si\n0.834348 0.165649 0.058289 Os\n0.165649 0.834348 0.941710 Os\n0.165649 0.834348 0.558289 Os\n0.834348 0.165649 0.441710 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sm",
"Si",
"Os",
"C"
],
"chemical_system": "C-Os-Si-Sm",
"density": 12.030601381077412,
"density_atomic": 0.0634506210975759,
"volume": 157.60287018501768,
"volume_molar": 9.491066684341837,
"formula_full": "Sm2 Si2 Os4 C2",
"formula_reduced": "SmSiOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.7164974950000005,
"spacegroup": 63
},
{
"id": "jvasp-105969",
"created_at": "2022-09-04T14:36:01.499774Z",
"updated_at": "2022-09-04T14:36:01.499796Z",
"structure_string": "U2 Si3 Ru1\n1.0\n3.686925 0.000000 0.000000\n0.000000 4.198600 0.000035\n0.000000 -0.000093 7.115997\nU Si Ru\n2 3 1\ndirect\n0.000000 0.999969 0.006104 U\n0.000000 0.499960 0.495564 U\n0.500001 0.499965 0.831164 Si\n0.500001 0.499971 0.160791 Si\n0.500001 0.999962 0.672714 Si\n0.500001 -0.000026 0.333661 Ru\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Si",
"Ru"
],
"chemical_system": "Ru-Si-U",
"density": 9.970075129756129,
"density_atomic": 0.05446865977099273,
"volume": 110.15508781061102,
"volume_molar": 11.056157403760997,
"formula_full": "U2 Si3 Ru1",
"formula_reduced": "U2Si3Ru",
"formula_anonymous": "AB2C3",
"energy_above_hull": 4.716224716666667,
"spacegroup": 25
},
{
"id": "jvasp-111712",
"created_at": "2022-09-04T14:38:41.084333Z",
"updated_at": "2022-09-04T14:38:41.084370Z",
"structure_string": "Zr12 Fe12 C4\n1.0\n7.236857 0.000000 4.178202\n2.412285 6.822975 4.178202\n0.000000 0.000000 8.356404\nZr Fe C\n12 12 4\ndirect\n0.800202 0.800202 0.199798 Zr\n0.449799 0.050201 0.050201 Zr\n0.050202 0.449799 0.449798 Zr\n0.050202 0.449799 0.050201 Zr\n0.050201 0.050201 0.449798 Zr\n0.449799 0.449799 0.050201 Zr\n0.449799 0.050201 0.449798 Zr\n0.199799 0.800202 0.800200 Zr\n0.199799 0.800202 0.199798 Zr\n0.800202 0.199799 0.800201 Zr\n0.199799 0.199799 0.800201 Zr\n0.800202 0.199799 0.199798 Zr\n0.427813 0.427813 0.427812 Fe\n0.822188 0.822188 0.822186 Fe\n0.822188 0.822188 0.533436 Fe\n0.822188 0.533438 0.822186 Fe\n0.533438 0.822188 0.822186 Fe\n0.427813 0.427813 0.716562 Fe\n0.625000 0.125000 0.624999 Fe\n0.716563 0.427813 0.427812 Fe\n0.625000 0.625000 0.624999 Fe\n0.625000 0.625000 0.124999 Fe\n0.125000 0.625000 0.624999 Fe\n0.427813 0.716563 0.427812 Fe\n0.125000 0.125000 0.625000 C\n0.625000 0.125000 0.125000 C\n0.125000 0.625000 0.124999 C\n0.125000 0.125000 0.125000 C\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Zr",
"Fe",
"C"
],
"chemical_system": "C-Fe-Zr",
"density": 7.295797174199879,
"density_atomic": 0.06786015261151043,
"volume": 412.613277784622,
"volume_molar": 8.874340136657054,
"formula_full": "Zr12 Fe12 C4",
"formula_reduced": "Zr3Fe3C",
"formula_anonymous": "AB3C3",
"energy_above_hull": 4.715417142857143,
"spacegroup": 227
},
{
"id": "jvasp-90934",
"created_at": "2022-09-04T14:36:09.148521Z",
"updated_at": "2022-09-04T14:36:09.148547Z",
"structure_string": "Al1 Si1 Tc2\n1.0\n-8.313953 -0.000000 -4.800062\n-8.679234 -0.002182 5.432749\n-5.663368 8.527978 0.209114\nAl Si Tc\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.000000 Si\n0.736166 0.000000 0.000000 Tc\n0.263834 0.000000 0.000000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Si",
"Tc"
],
"chemical_system": "Al-Si-Tc",
"density": 0.5629807025886154,
"density_atomic": 0.005401504006625856,
"volume": 740.5344872637927,
"volume_molar": 111.49007299842468,
"formula_full": "Al1 Si1 Tc2",
"formula_reduced": "AlSiTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.7149711,
"spacegroup": 71
},
{
"id": "jvasp-20335",
"created_at": "2022-09-04T14:38:33.192601Z",
"updated_at": "2022-09-04T14:38:33.192633Z",
"structure_string": "U6 P8\n1.0\n6.713090 -0.000000 -2.373436\n-3.356545 5.813707 -2.373436\n-0.000000 -0.000000 7.120307\nU P\n6 8\ndirect\n0.750000 0.875000 0.124999 U\n0.625000 0.375000 0.250000 U\n0.875000 0.125000 0.750000 U\n0.125000 0.750000 0.875000 U\n0.375000 0.250000 0.625000 U\n0.250000 0.625000 0.375000 U\n0.658294 0.658294 0.658293 P\n0.341706 0.500000 -0.000000 P\n0.500000 0.000000 0.341706 P\n-0.000000 0.341706 0.500000 P\n0.500000 0.000000 0.841706 P\n-0.000000 0.841707 0.500000 P\n0.158294 0.158294 0.158294 P\n0.841706 0.500000 -0.000001 P\n",
"nsites": 14,
"nelements": 2,
"elements": [
"U",
"P"
],
"chemical_system": "P-U",
"density": 10.014732164369084,
"density_atomic": 0.05037948301527433,
"volume": 277.8909024484313,
"volume_molar": 11.953558074770585,
"formula_full": "U6 P8",
"formula_reduced": "U3P4",
"formula_anonymous": "A3B4",
"energy_above_hull": 4.714682857142858,
"spacegroup": 220
},
{
"id": "jvasp-90735",
"created_at": "2022-09-04T14:35:51.807904Z",
"updated_at": "2022-09-04T14:35:51.807931Z",
"structure_string": "U2 Ni2 C4\n1.0\n3.505408 0.000000 -0.000000\n0.000000 3.505408 0.000000\n-0.000000 -0.000000 7.344327\nU Ni C\n2 2 4\ndirect\n0.750001 0.750001 0.678763 U\n0.250000 0.250000 0.321237 U\n0.750001 0.250000 0.000000 Ni\n0.250000 0.750001 0.000000 Ni\n0.750001 0.750001 0.164711 C\n0.250000 0.250000 0.835289 C\n0.750001 0.750001 0.361262 C\n0.250000 0.250000 0.638738 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"U",
"Ni",
"C"
],
"chemical_system": "C-Ni-U",
"density": 11.803426208479625,
"density_atomic": 0.08864634521101199,
"volume": 90.24624738850721,
"volume_molar": 6.793445060442161,
"formula_full": "U2 Ni2 C4",
"formula_reduced": "UNiC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.7144696,
"spacegroup": 129
},
{
"id": "jvasp-18020",
"created_at": "2022-09-04T14:37:27.603337Z",
"updated_at": "2022-09-04T14:37:27.603357Z",
"structure_string": "Cr3 Rh1 N1\n1.0\n3.812641 0.000000 0.000000\n0.000000 3.812641 0.000000\n-0.000000 -0.000000 3.812641\nCr Rh N\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cr",
"Rh",
"N"
],
"chemical_system": "Cr-N-Rh",
"density": 8.176655254357842,
"density_atomic": 0.09021780631540277,
"volume": 55.4214318016105,
"volume_molar": 6.675113268600776,
"formula_full": "Cr3 Rh1 N1",
"formula_reduced": "Cr3RhN",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.71436769,
"spacegroup": 221
},
{
"id": "jvasp-67677",
"created_at": "2022-09-04T14:36:17.035863Z",
"updated_at": "2022-09-04T14:36:17.035891Z",
"structure_string": "Mn1 Be1 Cr4\n1.0\n-0.000000 3.257518 3.257518\n3.257518 0.000000 3.257518\n3.257518 3.257518 -0.000000\nMn Be Cr\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Mn\n0.000000 0.000000 0.000000 Be\n0.122621 0.625793 0.625793 Cr\n0.625793 0.625793 0.625793 Cr\n0.625793 0.122621 0.625793 Cr\n0.625793 0.625793 0.122621 Cr\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Cr"
],
"chemical_system": "Be-Cr-Mn",
"density": 6.531653560155258,
"density_atomic": 0.08678822020353429,
"volume": 69.1338062461576,
"volume_molar": 6.938891874815472,
"formula_full": "Mn1 Be1 Cr4",
"formula_reduced": "MnBeCr4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.713410490229886,
"spacegroup": 216
},
{
"id": "jvasp-103801",
"created_at": "2022-09-04T14:37:14.669272Z",
"updated_at": "2022-09-04T14:37:14.669294Z",
"structure_string": "H4 C8 S2 O4\n1.0\n4.640253 -0.010365 -0.137817\n-0.744197 6.650092 -0.563860\n-0.077517 0.053642 7.023423\nH C S O\n4 8 2 4\ndirect\n0.590916 0.682598 0.028836 H\n0.723466 0.942690 0.075526 H\n0.590903 0.182623 0.528832 H\n0.723450 0.442713 0.575539 H\n0.814211 0.762800 0.302466 C\n0.814194 0.262811 0.802467 C\n0.328361 0.359658 0.711067 C\n0.616016 0.310158 0.638496 C\n0.328379 0.859645 0.211063 C\n0.616033 0.810141 0.138493 C\n0.100635 0.693599 0.247810 C\n0.100618 0.193610 0.747809 C\n0.156198 0.460779 0.259319 S\n0.156184 0.960791 0.759316 S\n0.283484 0.033039 0.260988 O\n0.748983 0.276427 0.970048 O\n0.748998 0.776421 0.470046 O\n0.283466 0.533050 0.761000 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.7486050073544763,
"density_atomic": 0.08304508403963617,
"volume": 216.7497354979961,
"volume_molar": 7.2516523158983395,
"formula_full": "H4 C8 S2 O4",
"formula_reduced": "H2C4SO2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 4.713044111111111,
"spacegroup": 1
}
]
}