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=formula_reduced&page=3367",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=3365",
"results": [
{
"id": "jvasp-75701",
"created_at": "2022-09-04T14:35:47.184239Z",
"updated_at": "2022-09-04T14:35:47.184265Z",
"structure_string": "Re2 Mo1 As1\n1.0\n-0.000000 3.140659 3.140659\n3.140659 0.000000 3.140659\n3.140659 3.140659 0.000000\nRe Mo As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Re\n0.750000 0.750000 0.750000 Mo\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Re",
"Mo",
"As"
],
"chemical_system": "As-Mo-Re",
"density": 14.560522065777885,
"density_atomic": 0.06456061229291553,
"volume": 61.95728104082641,
"volume_molar": 9.327886688368398,
"formula_full": "Re2 Mo1 As1",
"formula_reduced": "Re2MoAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.643975912499999,
"spacegroup": 216
},
{
"id": "jvasp-112649",
"created_at": "2022-09-04T14:38:41.608260Z",
"updated_at": "2022-09-04T14:38:41.608286Z",
"structure_string": "Re4 Mo2 Se8\n1.0\n6.712725 -0.011420 -0.433256\n-0.454499 6.697412 -0.397443\n-0.008808 0.000710 6.731486\nRe Mo Se\n4 2 8\ndirect\n0.546300 0.413580 0.237839 Re\n0.763746 0.455199 0.587586 Re\n0.584634 0.764333 0.452628 Re\n0.452771 0.586905 0.763947 Re\n0.234667 0.543294 0.412513 Mo\n0.412707 0.235601 0.547785 Mo\n0.369703 0.732913 0.122387 Se\n0.123354 0.369222 0.738139 Se\n0.739598 0.126555 0.369096 Se\n0.630628 0.269152 0.878421 Se\n0.872064 0.631415 0.266754 Se\n0.267874 0.873370 0.628011 Se\n0.214029 0.208040 0.207416 Se\n0.787925 0.790419 0.787483 Se\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Re",
"Mo",
"Se"
],
"chemical_system": "Mo-Re-Se",
"density": 8.607355738529098,
"density_atomic": 0.04626953979845583,
"volume": 302.5748702274153,
"volume_molar": 13.015346135344489,
"formula_full": "Re4 Mo2 Se8",
"formula_reduced": "Re2MoSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 4.079112195238095,
"spacegroup": 1
},
{
"id": "jvasp-35042",
"created_at": "2022-09-04T14:37:31.342042Z",
"updated_at": "2022-09-04T14:37:31.342053Z",
"structure_string": "Re4 N2\n1.0\n1.433707 -2.483253 -0.000000\n1.433707 2.483253 0.000000\n-0.000000 -0.000000 9.912508\nRe N\n4 2\ndirect\n0.333334 0.666668 0.394524 Re\n0.666668 0.333334 0.605476 Re\n0.666668 0.333334 0.894525 Re\n0.333334 0.666668 0.105476 Re\n0.333334 0.666668 0.750000 N\n0.666668 0.333334 0.250000 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 18.182121478727172,
"density_atomic": 0.085007320957304,
"volume": 70.58215612998292,
"volume_molar": 7.0842613226508995,
"formula_full": "Re4 N2",
"formula_reduced": "Re2N",
"formula_anonymous": "AB2",
"energy_above_hull": 5.617149749999999,
"spacegroup": 194
},
{
"id": "jvasp-60672",
"created_at": "2022-09-04T14:36:39.454030Z",
"updated_at": "2022-09-04T14:36:39.454060Z",
"structure_string": "Re2 Ni1 O8\n1.0\n2.849655 -4.935748 -0.000000\n2.849655 4.935748 0.000000\n-0.000000 0.000000 6.061289\nRe Ni O\n2 1 8\ndirect\n0.666667 0.333333 0.284503 Re\n0.333333 0.666667 0.715497 Re\n0.000000 0.000000 0.000000 Ni\n0.333333 0.666667 0.428079 O\n0.666667 0.333333 0.571921 O\n0.670289 0.832997 0.809881 O\n0.832998 0.162707 0.190119 O\n0.837293 0.670289 0.190119 O\n0.329711 0.167003 0.190119 O\n0.167002 0.837293 0.809881 O\n0.162707 0.329711 0.809881 O\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Re",
"Ni",
"O"
],
"chemical_system": "Ni-O-Re",
"density": 5.445031037164775,
"density_atomic": 0.06451377206201069,
"volume": 170.5062291106896,
"volume_molar": 9.334659201467112,
"formula_full": "Re2 Ni1 O8",
"formula_reduced": "Re2NiO8",
"formula_anonymous": "AB2C8",
"energy_above_hull": 3.625184218181818,
"spacegroup": 164
},
{
"id": "jvasp-9533",
"created_at": "2022-09-04T14:37:20.077185Z",
"updated_at": "2022-09-04T14:37:20.077211Z",
"structure_string": "Re4 O14\n1.0\n5.019321 0.000000 -1.365607\n-0.000000 5.379515 0.000000\n-0.319795 0.000000 8.731702\nRe O\n4 14\ndirect\n0.630347 0.250000 0.771145 Re\n0.859200 0.250000 0.228854 Re\n0.369654 0.749999 0.228854 Re\n0.140801 0.749999 0.771146 Re\n0.162581 0.749999 -0.000000 O\n0.837419 0.250000 -0.000000 O\n0.129307 0.000000 0.258616 O\n0.870694 0.500000 0.741385 O\n0.414112 0.000000 0.828221 O\n0.585889 0.500000 0.171779 O\n0.414112 0.500000 0.828221 O\n0.870694 0.000000 0.741385 O\n0.430763 0.250000 0.571948 O\n0.858814 0.250000 0.428051 O\n0.569238 0.749999 0.428051 O\n0.141187 0.749999 0.571949 O\n0.585889 0.000000 0.171779 O\n0.129307 0.500000 0.258616 O\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Re",
"O"
],
"chemical_system": "O-Re",
"density": 6.892142164906759,
"density_atomic": 0.07711426408468353,
"volume": 233.41985057697218,
"volume_molar": 7.8093733130705205,
"formula_full": "Re4 O14",
"formula_reduced": "Re2O7",
"formula_anonymous": "A2B7",
"energy_above_hull": 3.8777711666666654,
"spacegroup": 63
},
{
"id": "jvasp-30667",
"created_at": "2022-09-04T14:37:38.358404Z",
"updated_at": "2022-09-04T14:37:38.358437Z",
"structure_string": "Re4 O14\n1.0\n5.020335 0.000000 -1.365883\n0.000000 5.379136 -0.000000\n-0.321702 -0.000000 8.726692\nRe O\n4 14\ndirect\n0.630294 0.250000 0.770992 Re\n0.859300 0.250000 0.229008 Re\n0.369706 0.750000 0.229008 Re\n0.140699 0.750000 0.770992 Re\n0.162729 0.750000 0.000000 O\n0.837270 0.250000 0.000000 O\n0.129338 0.000000 0.258677 O\n0.870661 0.500000 0.741324 O\n0.414005 0.000000 0.828009 O\n0.585994 0.500000 0.171991 O\n0.414005 0.500000 0.828009 O\n0.870661 0.000000 0.741324 O\n0.430937 0.250000 0.571608 O\n0.859328 0.250000 0.428392 O\n0.569063 0.750000 0.428392 O\n0.140672 0.750000 0.571608 O\n0.585994 0.000000 0.171991 O\n0.129338 0.500000 0.258677 O\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Re",
"O"
],
"chemical_system": "O-Re",
"density": 6.895645818764694,
"density_atomic": 0.07715346549440455,
"volume": 233.30125075594208,
"volume_molar": 7.805405397424109,
"formula_full": "Re4 O14",
"formula_reduced": "Re2O7",
"formula_anonymous": "A2B7",
"energy_above_hull": 3.8777922777777776,
"spacegroup": 63
},
{
"id": "jvasp-20176",
"created_at": "2022-09-04T14:37:40.564027Z",
"updated_at": "2022-09-04T14:37:40.564042Z",
"structure_string": "Re8 P4\n1.0\n2.976751 -0.000000 0.000000\n-0.000000 5.583442 0.000000\n0.000000 0.000000 10.174457\nRe P\n8 4\ndirect\n0.750000 0.147084 0.787132 Re\n0.250000 0.852916 0.212868 Re\n0.750000 0.647084 0.712868 Re\n0.250000 0.352916 0.287132 Re\n0.250000 0.326388 0.564914 Re\n0.750000 0.673611 0.435086 Re\n0.250000 0.826388 0.935086 Re\n0.750000 0.173611 0.064914 Re\n0.250000 0.902479 0.602746 P\n0.750000 0.097521 0.397254 P\n0.250000 0.402479 0.897254 P\n0.750000 0.597521 0.102746 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Re",
"P"
],
"chemical_system": "P-Re",
"density": 15.844409171137663,
"density_atomic": 0.07096194131982624,
"volume": 169.10473102639443,
"volume_molar": 8.48643744519072,
"formula_full": "Re8 P4",
"formula_reduced": "Re2P",
"formula_anonymous": "AB2",
"energy_above_hull": 4.910790500000001,
"spacegroup": 62
},
{
"id": "jvasp-5650",
"created_at": "2022-09-04T14:36:48.435663Z",
"updated_at": "2022-09-04T14:36:48.435680Z",
"structure_string": "Re6 Pb3 O24\n1.0\n5.716389 -9.901074 -0.000000\n5.716389 9.901074 -0.000000\n-0.000000 -0.000000 4.612786\nRe Pb O\n6 3 24\ndirect\n0.000000 0.377515 0.985106 Re\n0.622485 0.622485 0.985106 Re\n0.377515 0.000000 0.985106 Re\n0.710616 0.000000 0.493730 Re\n0.289384 0.289384 0.493730 Re\n0.000000 0.710616 0.493730 Re\n0.000000 0.000000 0.019004 Pb\n0.333333 0.666667 0.461538 Pb\n0.666667 0.333333 0.461538 Pb\n0.624521 0.475654 0.097906 O\n0.524346 0.148866 0.097906 O\n0.475654 0.624521 0.097906 O\n0.148866 0.524346 0.097906 O\n0.853583 0.564312 0.611488 O\n0.000000 0.710617 0.117018 O\n0.289383 0.289383 0.117018 O\n0.710617 0.000000 0.117018 O\n0.851134 0.375480 0.097906 O\n0.375480 0.851134 0.097906 O\n0.229945 0.000000 0.092791 O\n0.146417 0.710729 0.611488 O\n0.000000 0.229945 0.092791 O\n0.289271 0.435688 0.611488 O\n0.435688 0.289271 0.611488 O\n0.564312 0.853583 0.611488 O\n0.000000 0.858428 0.603737 O\n0.141572 0.141572 0.603737 O\n0.858428 0.000000 0.603737 O\n0.000000 0.381391 0.608176 O\n0.618609 0.618609 0.608176 O\n0.381391 0.000000 0.608176 O\n0.770055 0.770055 0.092791 O\n0.710729 0.146417 0.611488 O\n",
"nsites": 33,
"nelements": 3,
"elements": [
"Re",
"Pb",
"O"
],
"chemical_system": "O-Pb-Re",
"density": 6.75097405736243,
"density_atomic": 0.06319992399767263,
"volume": 522.1525266583428,
"volume_molar": 9.528715193109676,
"formula_full": "Re6 Pb3 O24",
"formula_reduced": "Re2PbO8",
"formula_anonymous": "AB2C8",
"energy_above_hull": 3.5215404381818187,
"spacegroup": 157
},
{
"id": "jvasp-79289",
"created_at": "2022-09-04T14:36:39.472976Z",
"updated_at": "2022-09-04T14:36:39.473002Z",
"structure_string": "Re2 Pt1 Rh1\n1.0\n0.000000 3.126084 3.126084\n3.126084 0.000000 3.126084\n3.126084 3.126084 0.000000\nRe Pt Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Re\n0.749999 0.749999 0.749999 Re\n0.000000 0.000000 0.000000 Pt\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Re",
"Pt",
"Rh"
],
"chemical_system": "Pt-Re-Rh",
"density": 18.220212755741883,
"density_atomic": 0.0654678479036244,
"volume": 61.098693909847526,
"volume_molar": 9.198623374431413,
"formula_full": "Re2 Pt1 Rh1",
"formula_reduced": "Re2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.9758951,
"spacegroup": 225
},
{
"id": "jvasp-51324",
"created_at": "2022-09-04T14:36:32.420742Z",
"updated_at": "2022-09-04T14:36:32.420768Z",
"structure_string": "Re2 Ru1 Br1\n1.0\n-0.000006 3.143094 3.143103\n3.143083 0.000004 3.143091\n3.143086 3.143085 0.000002\nRe Ru Br\n2 1 1\ndirect\n0.250000 0.249999 0.249999 Re\n0.749998 0.750000 0.750000 Re\n0.499999 0.500002 0.499999 Ru\n-0.000000 0.000000 0.000001 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Re",
"Ru",
"Br"
],
"chemical_system": "Br-Re-Ru",
"density": 14.797155930420299,
"density_atomic": 0.06441090583204154,
"volume": 62.101284686640426,
"volume_molar": 9.349566943994528,
"formula_full": "Re2 Ru1 Br1",
"formula_reduced": "Re2RuBr",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.85797265125,
"spacegroup": 225
},
{
"id": "jvasp-25794",
"created_at": "2022-09-04T14:37:39.128261Z",
"updated_at": "2022-09-04T14:37:39.128280Z",
"structure_string": "Re4 S2 Cl24\n1.0\n0.000000 8.274335 -0.020070\n10.729669 0.000000 0.000000\n0.000000 -0.735802 -8.410948\nRe S Cl\n4 2 24\ndirect\n0.145954 0.250000 0.386612 Re\n0.645393 0.750000 0.395746 Re\n0.854046 0.750000 0.613389 Re\n0.354607 0.250000 0.604254 Re\n0.821252 0.250000 0.066226 S\n0.178748 0.750000 0.933774 S\n0.409372 0.750000 0.869753 Cl\n0.948215 0.404989 0.337431 Cl\n0.336895 0.075801 0.405403 Cl\n0.806167 0.750000 0.885184 Cl\n0.181773 0.898949 0.085233 Cl\n0.051784 0.595011 0.662569 Cl\n0.378058 0.406108 0.790580 Cl\n0.939110 0.750000 0.343475 Cl\n0.663105 0.575801 0.594597 Cl\n0.060890 0.250000 0.656525 Cl\n0.663105 0.924199 0.594597 Cl\n0.818227 0.398949 0.914767 Cl\n0.590628 0.250000 0.130247 Cl\n0.621941 0.593892 0.209420 Cl\n0.818227 0.101051 0.914767 Cl\n0.336895 0.424199 0.405403 Cl\n0.375805 0.750000 0.438039 Cl\n0.948215 0.095011 0.337431 Cl\n0.378058 0.093892 0.790580 Cl\n0.624195 0.250000 0.561961 Cl\n0.181773 0.601051 0.085233 Cl\n0.621941 0.906108 0.209420 Cl\n0.193833 0.250000 0.114816 Cl\n0.051784 0.904989 0.662569 Cl\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Re",
"S",
"Cl"
],
"chemical_system": "Cl-Re-S",
"density": 3.690253411008414,
"density_atomic": 0.04016656914655599,
"volume": 746.8897801686479,
"volume_molar": 14.992917961270182,
"formula_full": "Re4 S2 Cl24",
"formula_reduced": "Re2SCl12",
"formula_anonymous": "AB2C12",
"energy_above_hull": 1.3725403206666666,
"spacegroup": 11
},
{
"id": "jvasp-59501",
"created_at": "2022-09-04T14:37:54.724119Z",
"updated_at": "2022-09-04T14:37:54.724140Z",
"structure_string": "Re8 W12 C4\n1.0\n6.956425 -0.000000 0.000000\n0.000000 6.956425 -0.000000\n0.000000 -0.000000 6.956425\nRe W C\n8 12 4\ndirect\n0.681567 0.681567 0.681567 Re\n0.931567 0.568434 0.431566 Re\n0.568434 0.431566 0.931567 Re\n0.431566 0.931567 0.568434 Re\n0.181566 0.818434 0.318434 Re\n0.818434 0.318434 0.181566 Re\n0.318434 0.181566 0.818434 Re\n0.068434 0.068434 0.068434 Re\n0.294022 0.544022 0.625000 W\n0.455979 0.125000 0.205979 W\n0.044021 0.875001 0.705979 W\n0.794022 0.955979 0.375000 W\n0.205979 0.455979 0.125000 W\n0.875001 0.705979 0.044021 W\n0.955979 0.375000 0.794022 W\n0.125000 0.205979 0.455979 W\n0.544022 0.625000 0.294022 W\n0.705979 0.044021 0.875001 W\n0.625000 0.294022 0.544022 W\n0.375000 0.794022 0.955979 W\n0.625000 0.875001 0.125000 C\n0.875001 0.125000 0.625000 C\n0.125000 0.625000 0.875001 C\n0.375000 0.375000 0.375000 C\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Re",
"W",
"C"
],
"chemical_system": "C-Re-W",
"density": 18.467195915331345,
"density_atomic": 0.07129398987977917,
"volume": 336.6342666537593,
"volume_molar": 8.446912243451303,
"formula_full": "Re8 W12 C4",
"formula_reduced": "Re2W3C",
"formula_anonymous": "AB2C3",
"energy_above_hull": 8.061362666666666,
"spacegroup": 213
}
]
}