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=-density_atomic&page=1231",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=1229",
"results": [
{
"id": "jvasp-41275",
"created_at": "2022-09-04T14:37:17.676072Z",
"updated_at": "2022-09-04T14:37:17.676091Z",
"structure_string": "Mn2 Ru6\n1.0\n2.681651 -4.644756 -0.000000\n2.681651 4.644756 0.000000\n0.000000 -0.000000 4.207254\nMn Ru\n2 6\ndirect\n0.333333 0.666667 0.749999 Mn\n0.666667 0.333333 0.250000 Mn\n0.658534 0.829267 0.250000 Ru\n0.170732 0.829267 0.250000 Ru\n0.170733 0.341465 0.250000 Ru\n0.341465 0.170733 0.749999 Ru\n0.829267 0.170732 0.749999 Ru\n0.829267 0.658534 0.749999 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Ru"
],
"chemical_system": "Mn-Ru",
"density": 11.348743736024106,
"density_atomic": 0.07633014693811728,
"volume": 104.80786846232323,
"volume_molar": 7.88959670794594,
"formula_full": "Mn2 Ru6",
"formula_reduced": "MnRu3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.428294685344828,
"spacegroup": 194
},
{
"id": "jvasp-54512",
"created_at": "2022-09-04T14:38:30.723616Z",
"updated_at": "2022-09-04T14:38:30.723634Z",
"structure_string": "V2 Zn4 P4 O18\n1.0\n7.343873 -0.024106 -2.662191\n-3.726413 6.399095 -2.487118\n-0.014038 0.024106 7.811501\nV Zn P O\n2 4 4 18\ndirect\n0.000000 0.600511 0.600511 V\n0.000000 0.100511 0.100511 V\n0.263391 0.148342 0.648342 Zn\n0.500000 0.884949 0.148341 Zn\n0.500000 0.648341 0.384949 Zn\n0.736608 0.384949 0.884949 Zn\n0.500000 0.313865 0.427359 P\n0.886505 0.813865 0.313865 P\n0.500000 0.927359 0.813865 P\n0.113494 0.427360 0.927359 P\n0.037635 0.016618 0.324630 O\n0.287665 0.633987 0.133987 O\n0.308012 0.324629 0.286996 O\n0.500000 0.133988 0.846323 O\n0.308012 0.786995 0.824629 O\n0.691987 0.978982 0.016618 O\n0.500000 0.116904 0.323650 O\n0.712335 0.846322 0.346322 O\n0.962365 0.478983 0.786995 O\n0.037635 0.824629 0.516618 O\n0.000000 0.424239 0.424239 O\n0.691987 0.516618 0.478983 O\n0.793254 0.616903 0.116904 O\n0.962365 0.286996 0.978983 O\n0.500000 0.346323 0.633988 O\n0.000000 0.924239 0.924239 O\n0.206745 0.323651 0.823650 O\n0.500000 0.823650 0.616904 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"V",
"Zn",
"P",
"O"
],
"chemical_system": "O-P-V-Zn",
"density": 3.510014162566773,
"density_atomic": 0.07632910794674815,
"volume": 366.8325328724464,
"volume_molar": 7.889704101089999,
"formula_full": "V2 Zn4 P4 O18",
"formula_reduced": "VZn2P2O9",
"formula_anonymous": "AB2C2D9",
"energy_above_hull": 2.39318625,
"spacegroup": 108
},
{
"id": "jvasp-86314",
"created_at": "2022-09-04T14:35:41.649814Z",
"updated_at": "2022-09-04T14:35:41.649841Z",
"structure_string": "Ce2 Fe17\n1.0\n6.294712 0.062487 0.855164\n0.755163 6.249562 0.855164\n0.069792 0.062487 6.352152\nCe Fe\n2 17\ndirect\n0.341352 0.341352 0.341351 Ce\n0.658647 0.658648 0.658647 Ce\n0.841650 0.341138 0.341137 Fe\n0.158349 0.658862 0.658861 Fe\n0.658861 0.658862 0.158349 Fe\n0.658861 0.158350 0.658861 Fe\n0.295954 0.000000 0.704046 Fe\n-0.000000 0.704046 0.295953 Fe\n0.704046 0.295954 -0.000001 Fe\n0.341137 0.341138 0.841650 Fe\n0.295954 0.704046 -0.000001 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.905329 0.905330 0.905328 Fe\n0.094670 0.094670 0.094670 Fe\n0.341137 0.841650 0.341137 Fe\n-0.000000 0.295954 0.704046 Fe\n0.704046 0.000000 0.295953 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"Fe"
],
"chemical_system": "Ce-Fe",
"density": 8.202495144820848,
"density_atomic": 0.07632866922134364,
"volume": 248.92350664338673,
"volume_molar": 7.889749449890895,
"formula_full": "Ce2 Fe17",
"formula_reduced": "Ce2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.163699710526315,
"spacegroup": 166
},
{
"id": "jvasp-74431",
"created_at": "2022-09-04T14:35:51.570602Z",
"updated_at": "2022-09-04T14:35:51.570629Z",
"structure_string": "Be2 Hg1 Ir1\n1.0\n-1.746145 1.746145 4.296911\n1.746145 -1.746145 4.296911\n1.746145 1.746145 -4.296911\nBe Hg Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.500000 0.500000 0.000000 Hg\n0.750001 0.250000 0.500001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Hg",
"Ir"
],
"chemical_system": "Be-Hg-Ir",
"density": 13.017744090829401,
"density_atomic": 0.0763278504897444,
"volume": 52.40551088933717,
"volume_molar": 7.88983407938253,
"formula_full": "Be2 Hg1 Ir1",
"formula_reduced": "Be2HgIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.700999475,
"spacegroup": 119
},
{
"id": "jvasp-30046",
"created_at": "2022-09-04T14:38:04.615439Z",
"updated_at": "2022-09-04T14:38:04.615459Z",
"structure_string": "Bi2 F6\n1.0\n4.101011 -0.000000 -0.000000\n-2.050506 3.551580 -0.000000\n-0.000000 0.000000 7.196056\nBi F\n2 6\ndirect\n0.666666 0.333333 0.750000 Bi\n0.333332 0.666667 0.250000 Bi\n0.000000 0.000000 0.250000 F\n0.000000 0.000000 0.750000 F\n0.333332 0.666667 0.578667 F\n0.333332 0.666667 0.921334 F\n0.666666 0.333333 0.078667 F\n0.666666 0.333333 0.421334 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Bi",
"F"
],
"chemical_system": "Bi-F",
"density": 8.42779252876572,
"density_atomic": 0.07632783020694359,
"volume": 104.81104963039071,
"volume_molar": 7.889836175969486,
"formula_full": "Bi2 F6",
"formula_reduced": "BiF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0100325,
"spacegroup": 194
},
{
"id": "jvasp-70949",
"created_at": "2022-09-04T14:36:11.581933Z",
"updated_at": "2022-09-04T14:36:11.581959Z",
"structure_string": "Be1 Cu4 Ge1\n1.0\n0.000000 3.400006 3.400006\n3.400006 -0.000000 3.400006\n3.400006 3.400006 0.000000\nBe Cu Ge\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.123476 0.625509 0.625509 Cu\n0.625509 0.625509 0.625509 Cu\n0.625509 0.123476 0.625509 Cu\n0.625509 0.625509 0.123476 Cu\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Ge"
],
"chemical_system": "Be-Cu-Ge",
"density": 7.094267095376848,
"density_atomic": 0.07632770500974746,
"volume": 78.6084161607344,
"volume_molar": 7.8898491173433545,
"formula_full": "Be1 Cu4 Ge1",
"formula_reduced": "BeCu4Ge",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2186673083333333,
"spacegroup": 216
},
{
"id": "jvasp-16592",
"created_at": "2022-09-04T14:37:44.655673Z",
"updated_at": "2022-09-04T14:37:44.655698Z",
"structure_string": "Ni3 Sn1\n1.0\n3.637752 -0.000000 2.100257\n1.212584 3.429705 2.100257\n-0.000000 -0.000000 4.200514\nNi Sn\n3 1\ndirect\n0.499999 0.500001 0.500000 Ni\n0.250000 0.250000 0.250000 Ni\n0.749999 0.750001 0.750001 Ni\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ni",
"Sn"
],
"chemical_system": "Ni-Sn",
"density": 9.340494046413665,
"density_atomic": 0.07632515590393954,
"volume": 52.407361015210704,
"volume_molar": 7.890112622343385,
"formula_full": "Ni3 Sn1",
"formula_reduced": "Ni3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.851019725,
"spacegroup": 225
},
{
"id": "jvasp-35135",
"created_at": "2022-09-04T14:37:33.645809Z",
"updated_at": "2022-09-04T14:37:33.645836Z",
"structure_string": "Ce6 Zr2 O16\n1.0\n7.624079 -0.032576 -0.038004\n-0.032575 7.624079 -0.038004\n-0.027047 -0.027047 5.410048\nCe Zr O\n6 2 16\ndirect\n0.007250 0.003216 0.009204 Ce\n0.000736 0.499264 0.000000 Ce\n0.253217 0.757250 0.509205 Ce\n0.742750 0.246783 0.490797 Ce\n0.496784 0.492749 0.990797 Ce\n0.749265 0.750735 0.500001 Ce\n0.242277 0.257723 0.500001 Zr\n0.507724 0.992277 0.000001 Zr\n0.488079 0.768665 0.227214 O\n0.739302 0.505729 0.253177 O\n0.731335 0.011920 0.772788 O\n0.479764 0.260263 0.696559 O\n0.510263 0.229763 0.196559 O\n0.756031 0.991234 0.260091 O\n0.241234 0.506028 0.760089 O\n0.270237 0.989737 0.803443 O\n0.010699 0.744270 0.246824 O\n0.261923 0.481335 0.272787 O\n0.508766 0.743970 0.739912 O\n0.018665 0.238077 0.727214 O\n0.993972 0.258766 0.239913 O\n0.239736 0.020235 0.303442 O\n0.994271 0.760698 0.746826 O\n0.755730 0.489301 0.753177 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ce",
"Zr",
"O"
],
"chemical_system": "Ce-O-Zr",
"density": 6.754901959543692,
"density_atomic": 0.0763246841322001,
"volume": 314.4461097071845,
"volume_molar": 7.890161392046114,
"formula_full": "Ce6 Zr2 O16",
"formula_reduced": "Ce3ZrO8",
"formula_anonymous": "AB3C8",
"energy_above_hull": 2.759437416666667,
"spacegroup": 15
},
{
"id": "jvasp-55733",
"created_at": "2022-09-04T14:38:35.600875Z",
"updated_at": "2022-09-04T14:38:35.600894Z",
"structure_string": "K4 Na2 Al2 H12\n1.0\n5.701339 -0.000000 0.000000\n0.000000 5.701118 0.000000\n0.000000 0.000000 8.061765\nK Na Al H\n4 2 2 12\ndirect\n0.500000 0.000000 0.250003 K\n0.000000 0.500000 0.249996 K\n0.500000 0.000000 0.749996 K\n0.000000 0.500000 0.750003 K\n0.000000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 0.720372 H\n0.000000 0.000000 0.779627 H\n0.279572 0.720280 0.500000 H\n0.220429 0.220280 0.000000 H\n0.720429 0.279721 0.500000 H\n0.779741 0.220449 0.000000 H\n0.220259 0.779551 0.000000 H\n0.279741 0.279551 0.500000 H\n0.000000 0.000000 0.220373 H\n0.720259 0.720449 0.500000 H\n0.779572 0.779721 0.000000 H\n0.500000 0.500000 0.279627 H\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Na",
"Al",
"H"
],
"chemical_system": "Al-H-K-Na",
"density": 1.7010414350088534,
"density_atomic": 0.07632432401136344,
"volume": 262.0396611311268,
"volume_molar": 7.8901986201717325,
"formula_full": "K4 Na2 Al2 H12",
"formula_reduced": "K2NaAlH6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.70826178,
"spacegroup": 225
},
{
"id": "jvasp-71671",
"created_at": "2022-09-04T14:35:43.065115Z",
"updated_at": "2022-09-04T14:35:43.065140Z",
"structure_string": "Sc1 Be1 Cr2\n1.0\n3.550346 0.000000 0.000000\n-0.000000 3.550346 -0.000000\n0.000000 0.000000 4.157919\nSc Be Cr\n1 1 2\ndirect\n0.500001 0.500001 0.500000 Sc\n0.000000 0.000000 0.500000 Be\n0.500001 0.000000 0.000000 Cr\n0.000000 0.500001 0.000000 Cr\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Cr"
],
"chemical_system": "Be-Cr-Sc",
"density": 5.004718414950383,
"density_atomic": 0.07632074619818253,
"volume": 52.41038903908482,
"volume_molar": 7.890568501993248,
"formula_full": "Sc1 Be1 Cr2",
"formula_reduced": "ScBeCr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5768215375,
"spacegroup": 123
},
{
"id": "jvasp-47996",
"created_at": "2022-09-04T14:36:07.646015Z",
"updated_at": "2022-09-04T14:36:07.646031Z",
"structure_string": "Li2 Mn1 F4\n1.0\n0.000000 4.783570 0.000000\n2.391786 -2.391786 4.008224\n4.783570 -0.000000 -0.000000\nLi Mn F\n2 1 4\ndirect\n0.500000 -0.000000 0.500000 Li\n0.749999 0.500000 0.750001 Li\n0.000000 0.000000 0.000000 Mn\n0.408007 0.233328 0.113976 F\n0.652695 0.766671 0.408009 F\n0.825319 0.233328 0.652696 F\n0.113974 0.766671 0.825321 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 2.62181696660807,
"density_atomic": 0.07632060225281072,
"volume": 91.71835380455487,
"volume_molar": 7.890583384093014,
"formula_full": "Li2 Mn1 F4",
"formula_reduced": "Li2MnF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.4293911959113298,
"spacegroup": 82
},
{
"id": "jvasp-96886",
"created_at": "2022-09-04T14:36:19.337594Z",
"updated_at": "2022-09-04T14:36:19.337624Z",
"structure_string": "Y4 Si4 O14\n1.0\n4.708312 0.511039 0.000000\n-0.011775 5.614642 0.000000\n0.000000 0.000000 10.901747\nY Si O\n4 4 14\ndirect\n0.112854 0.092793 0.150420 Y\n0.887147 0.907207 0.849580 Y\n0.112854 0.592793 0.349580 Y\n0.887146 0.407207 0.650420 Y\n0.640833 0.143787 0.387617 Si\n0.359167 0.356213 0.887618 Si\n0.359168 0.856213 0.612383 Si\n0.640833 0.643787 0.112383 Si\n0.382415 0.752210 0.203112 O\n0.617586 0.747789 0.703112 O\n0.617585 0.247790 0.796888 O\n0.794381 0.867415 0.051465 O\n0.500000 0.500000 0.000000 O\n0.879069 0.459171 0.182511 O\n0.120931 0.040829 0.682511 O\n0.120931 0.540829 0.817490 O\n0.879070 0.959171 0.317489 O\n0.794380 0.367416 0.448535 O\n0.205620 0.132585 0.948535 O\n0.205620 0.632584 0.551465 O\n0.500000 0.000000 0.500000 O\n0.382415 0.252210 0.296888 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Y",
"Si",
"O"
],
"chemical_system": "O-Si-Y",
"density": 3.9860794865605063,
"density_atomic": 0.07632036364283493,
"volume": 288.2585846020847,
"volume_molar": 7.890608053418738,
"formula_full": "Y4 Si4 O14",
"formula_reduced": "Y2Si2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.8732238727272725,
"spacegroup": 14
}
]
}