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=950",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=948",
"results": [
{
"id": "jvasp-68758",
"created_at": "2022-09-04T14:35:56.660778Z",
"updated_at": "2022-09-04T14:35:56.660814Z",
"structure_string": "Be2 Co2 Se1\n1.0\n-1.652910 1.652910 5.570251\n1.652910 -1.652910 5.570251\n1.652910 1.652910 -5.570251\nBe Co Se\n2 2 1\ndirect\n0.604093 0.604093 0.000000 Be\n0.395907 0.395907 0.000000 Be\n0.750000 0.250000 0.500000 Co\n0.250000 0.750000 0.500000 Co\n0.000000 0.000000 0.000000 Se\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Be",
"Co",
"Se"
],
"chemical_system": "Be-Co-Se",
"density": 5.860744770974856,
"density_atomic": 0.08213662117620839,
"volume": 60.87418654918198,
"volume_molar": 7.3318584009934495,
"formula_full": "Be2 Co2 Se1",
"formula_reduced": "Be2Co2Se",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.544661473333334,
"spacegroup": 139
},
{
"id": "jvasp-61514",
"created_at": "2022-09-04T14:36:04.934823Z",
"updated_at": "2022-09-04T14:36:04.934850Z",
"structure_string": "Li1 Au1 F6\n1.0\n4.800920 -2.476882 0.016976\n4.800920 2.476882 0.016976\n3.508586 -0.000000 4.107784\nLi Au F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Au\n0.759146 0.395587 0.091145 F\n0.395587 0.091144 0.759146 F\n0.091144 0.759146 0.395587 F\n0.240854 0.604413 0.908856 F\n0.604413 0.908856 0.240855 F\n0.908856 0.240854 0.604413 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Au",
"F"
],
"chemical_system": "Au-F-Li",
"density": 5.41979844719253,
"density_atomic": 0.08213651010730645,
"volume": 97.3988301858513,
"volume_molar": 7.331868315481668,
"formula_full": "Li1 Au1 F6",
"formula_reduced": "LiAuF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-120716",
"created_at": "2022-09-04T14:38:48.480328Z",
"updated_at": "2022-09-04T14:38:48.480360Z",
"structure_string": "Na4 Mn2 P2 H2 O6 F8\n1.0\n5.688523 0.020959 -0.000322\n-2.200068 6.629143 0.000890\n0.000282 -0.000960 7.739066\nNa Mn P H O F\n4 2 2 2 6 8\ndirect\n0.500005 -0.000001 0.499999 Na\n0.499993 0.000001 -0.000001 Na\n0.480478 0.471780 0.749986 Na\n0.519519 0.528219 0.250007 Na\n0.000004 0.500002 0.000000 Mn\n-0.000004 0.499998 0.500000 Mn\n0.950176 0.881638 0.749998 P\n0.049824 0.118364 0.250007 P\n0.901991 0.185430 0.750002 H\n0.098006 0.814569 0.250003 H\n0.915493 0.766108 0.915823 O\n0.084513 0.233894 0.415833 O\n0.084530 0.233906 0.084187 O\n0.204352 0.965146 0.250009 O\n0.795647 0.034854 0.749998 O\n0.915464 0.766093 0.584178 O\n0.372599 0.662801 0.492864 F\n0.055605 0.391401 0.750002 F\n0.944392 0.608598 0.250000 F\n0.235000 0.031342 0.749990 F\n0.764998 0.968658 0.249996 F\n0.627392 0.337196 0.507130 F\n0.372606 0.662806 0.007161 F\n0.627403 0.337196 0.992833 F\n",
"nsites": 24,
"nelements": 6,
"elements": [
"Na",
"Mn",
"P",
"H",
"O",
"F"
],
"chemical_system": "F-H-Mn-Na-O-P",
"density": 2.919792316849775,
"density_atomic": 0.08213628470756004,
"volume": 292.1972924079798,
"volume_molar": 7.331888435715556,
"formula_full": "Na4 Mn2 P2 H2 O6 F8",
"formula_reduced": "Na2MnPHO3F4",
"formula_anonymous": "ABCD2E3F4",
"energy_above_hull": 1.3315943642816093,
"spacegroup": 11
},
{
"id": "jvasp-54486",
"created_at": "2022-09-04T14:37:46.242285Z",
"updated_at": "2022-09-04T14:37:46.242311Z",
"structure_string": "Ba1 Co2 P2 O8\n1.0\n4.814443 -0.003360 -0.006183\n-2.404793 4.174879 -0.003106\n-2.394770 -1.376480 7.882704\nBa Co P O\n1 2 2 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.336524 0.167848 0.505320 Co\n0.663476 0.832152 0.494679 Co\n0.149367 0.574671 0.724277 P\n0.850633 0.425329 0.275722 P\n0.902226 0.144011 0.340630 O\n0.278542 0.639197 0.917782 O\n0.721458 0.360803 0.082217 O\n0.583063 0.438950 0.341057 O\n0.097774 0.855989 0.659369 O\n0.802972 0.241957 0.659370 O\n0.197028 0.758043 0.340629 O\n0.416936 0.561050 0.658943 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Co",
"P",
"O"
],
"chemical_system": "Ba-Co-O-P",
"density": 4.670180077447103,
"density_atomic": 0.08213628417003566,
"volume": 158.273534423445,
"volume_molar": 7.331888483697624,
"formula_full": "Ba1 Co2 P2 O8",
"formula_reduced": "BaCo2(PO4)2",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 2.817330520769231,
"spacegroup": 148
},
{
"id": "jvasp-41387",
"created_at": "2022-09-04T14:38:33.836811Z",
"updated_at": "2022-09-04T14:38:33.836838Z",
"structure_string": "Co6 Pt2\n1.0\n5.213373 -0.000082 -0.000064\n-2.606757 4.514952 0.000093\n-0.000049 0.000055 4.138049\nCo Pt\n6 2\ndirect\n0.157843 0.315711 0.249997 Co\n0.684308 0.842157 0.250001 Co\n0.157838 0.842142 0.250004 Co\n0.842155 0.684294 0.750006 Co\n0.315692 0.157852 0.750002 Co\n0.842165 0.157865 0.749999 Co\n0.333345 0.666673 0.750004 Pt\n0.666654 0.333317 0.249999 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Co",
"Pt"
],
"chemical_system": "Co-Pt",
"density": 12.680094238045003,
"density_atomic": 0.08213464154698928,
"volume": 97.40104600594373,
"volume_molar": 7.332035115237861,
"formula_full": "Co6 Pt2",
"formula_reduced": "Co3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 3.094293525,
"spacegroup": 194
},
{
"id": "jvasp-30787",
"created_at": "2022-09-04T14:38:36.800868Z",
"updated_at": "2022-09-04T14:38:36.800892Z",
"structure_string": "Mg4 V12 O28\n1.0\n5.267702 -0.000000 -0.000000\n-0.000000 10.111882 0.000000\n0.000001 -0.000000 10.058089\nMg V O\n4 12 28\ndirect\n0.651545 0.750000 0.919914 Mg\n0.151544 0.250000 0.580085 Mg\n0.348454 0.250000 0.080086 Mg\n0.848455 0.750000 0.419915 Mg\n0.713103 0.973358 0.681438 V\n0.286897 0.473358 0.318562 V\n0.786897 0.526641 0.181438 V\n0.204081 0.750000 0.712232 V\n0.704081 0.250000 0.787769 V\n0.213102 0.026641 0.818562 V\n0.295919 0.750000 0.212231 V\n0.213102 0.473358 0.818562 V\n0.713103 0.526641 0.681438 V\n0.786897 0.973358 0.181438 V\n0.286897 0.026641 0.318562 V\n0.795919 0.250000 0.287769 V\n0.972938 0.618611 0.782688 O\n0.183371 0.750000 0.548331 O\n0.683369 0.250000 0.951670 O\n0.816629 0.250000 0.451669 O\n0.316631 0.750000 0.048330 O\n0.772769 0.907411 0.031237 O\n0.727230 0.592588 0.531237 O\n0.272770 0.092588 0.468763 O\n0.772769 0.592588 0.031237 O\n0.272770 0.407411 0.468763 O\n0.472937 0.381388 0.717313 O\n0.227231 0.407411 0.968763 O\n0.027062 0.118612 0.217312 O\n0.547169 0.121189 0.214246 O\n0.027062 0.381388 0.217312 O\n0.527062 0.618611 0.282687 O\n0.972938 0.881388 0.782688 O\n0.472937 0.118612 0.717313 O\n0.452831 0.621189 0.785754 O\n0.952831 0.378811 0.714247 O\n0.227231 0.092588 0.968763 O\n0.047169 0.878811 0.285753 O\n0.547169 0.378811 0.214246 O\n0.047169 0.621189 0.285753 O\n0.452831 0.878811 0.785754 O\n0.952831 0.121189 0.714247 O\n0.527062 0.881388 0.282687 O\n0.727230 0.907411 0.531237 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 3.584482955015592,
"density_atomic": 0.082126631622424,
"volume": 535.7580011595917,
"volume_molar": 7.332750218816601,
"formula_full": "Mg4 V12 O28",
"formula_reduced": "MgV3O7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.9667787409090907,
"spacegroup": 62
},
{
"id": "jvasp-24638",
"created_at": "2022-09-04T14:37:14.641117Z",
"updated_at": "2022-09-04T14:37:14.641136Z",
"structure_string": "Nb2 Al2 O8\n1.0\n3.804572 0.000000 0.000000\n-1.902286 5.858815 -1.852397\n0.000000 -0.033356 6.565952\nNb Al O\n2 2 8\ndirect\n0.104661 0.209321 0.237300 Nb\n0.895337 0.790678 0.762699 Nb\n0.798203 0.596407 0.175849 Al\n0.201795 0.403591 0.824150 Al\n0.355953 0.711907 0.796099 O\n0.644045 0.288091 0.203900 O\n0.736543 0.473088 0.858744 O\n0.263454 0.526910 0.141255 O\n0.859768 0.719537 0.471497 O\n0.140230 0.280461 0.528501 O\n0.942096 0.884195 0.136454 O\n0.057902 0.115803 0.863544 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"Al",
"O"
],
"chemical_system": "Al-Nb-O",
"density": 4.1793760770716695,
"density_atomic": 0.08212324023801622,
"volume": 146.12185253797378,
"volume_molar": 7.333053034130345,
"formula_full": "Nb2 Al2 O8",
"formula_reduced": "NbAlO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.613706033333333,
"spacegroup": 12
},
{
"id": "jvasp-68631",
"created_at": "2022-09-04T14:35:56.837284Z",
"updated_at": "2022-09-04T14:35:56.837312Z",
"structure_string": "Be2 Ni1 Cl1\n1.0\n2.875422 0.000000 0.000000\n0.000000 2.875422 0.000000\n0.000000 0.000000 5.891161\nBe Ni Cl\n2 1 1\ndirect\n0.000000 0.000000 0.680033 Be\n0.000000 0.000000 0.319967 Be\n0.500000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ni",
"Cl"
],
"chemical_system": "Be-Cl-Ni",
"density": 3.8240600293887144,
"density_atomic": 0.08212131916878775,
"volume": 48.70842359191302,
"volume_molar": 7.333224576705125,
"formula_full": "Be2 Ni1 Cl1",
"formula_reduced": "Be2NiCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.202962166875,
"spacegroup": 123
},
{
"id": "jvasp-113555",
"created_at": "2022-09-04T14:38:47.607549Z",
"updated_at": "2022-09-04T14:38:47.607578Z",
"structure_string": "Li2 Ca2 N2\n1.0\n3.562614 -0.000000 -0.000000\n-1.781307 3.085315 0.000000\n0.000000 0.000000 6.647229\nLi Ca N\n2 2 2\ndirect\n0.666665 0.333332 0.750000 Li\n0.333331 0.666665 0.250000 Li\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.666665 0.333332 0.250000 N\n0.333331 0.666665 0.750000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Ca",
"N"
],
"chemical_system": "Ca-Li-N",
"density": 2.7738498026795853,
"density_atomic": 0.08211874979528662,
"volume": 73.06492140902495,
"volume_molar": 7.33345402239143,
"formula_full": "Li2 Ca2 N2",
"formula_reduced": "LiCaN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3315878899999998,
"spacegroup": 194
},
{
"id": "jvasp-37027",
"created_at": "2022-09-04T14:38:05.548441Z",
"updated_at": "2022-09-04T14:38:05.548463Z",
"structure_string": "Ti1 Ga1 Fe1 Co1\n1.0\n2.898677 2.898677 0.000000\n2.898677 -0.000000 -2.898677\n-0.000000 2.898677 -2.898677\nTi Ga Fe Co\n1 1 1 1\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Ga\n0.750001 0.750001 0.750001 Fe\n0.250000 0.250000 0.250000 Co\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Ti",
"Ga",
"Fe",
"Co"
],
"chemical_system": "Co-Fe-Ga-Ti",
"density": 7.921297285234834,
"density_atomic": 0.08211651731421374,
"volume": 48.71127187109323,
"volume_molar": 7.333653395158801,
"formula_full": "Ti1 Ga1 Fe1 Co1",
"formula_reduced": "TiGaFeCo",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.398524264583333,
"spacegroup": 216
},
{
"id": "jvasp-114411",
"created_at": "2022-09-04T14:38:40.694468Z",
"updated_at": "2022-09-04T14:38:40.694497Z",
"structure_string": "Zr1 Zn1 O4\n1.0\n3.350503 -3.367970 0.000000\n3.350503 3.367970 0.000000\n0.000000 0.000000 3.237646\nZr Zn O\n1 1 4\ndirect\n0.000000 0.000000 0.500001 Zr\n0.500000 0.500000 0.000000 Zn\n0.197966 0.197966 0.000000 O\n0.310423 0.689578 0.500001 O\n0.689578 0.310423 0.500001 O\n0.802034 0.802034 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Zn",
"O"
],
"chemical_system": "O-Zn-Zr",
"density": 5.013918386498288,
"density_atomic": 0.08211333049834253,
"volume": 73.06974353112021,
"volume_molar": 7.333938014025089,
"formula_full": "Zr1 Zn1 O4",
"formula_reduced": "ZrZnO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.964501483333334,
"spacegroup": 65
},
{
"id": "jvasp-106176",
"created_at": "2022-09-04T14:36:11.579061Z",
"updated_at": "2022-09-04T14:36:11.579088Z",
"structure_string": "K1 Cr1 O2\n1.0\n2.983764 -0.000968 5.414084\n1.392357 2.638975 5.414084\n-0.001606 -0.000968 6.181841\nK Cr O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.499999 0.500000 0.500000 Cr\n0.776710 0.776712 0.776712 O\n0.223287 0.223288 0.223288 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Cr",
"O"
],
"chemical_system": "Cr-K-O",
"density": 4.195774847830983,
"density_atomic": 0.08210866803247518,
"volume": 48.71592848659951,
"volume_molar": 7.334354465009901,
"formula_full": "K1 Cr1 O2",
"formula_reduced": "KCrO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6709031,
"spacegroup": 166
}
]
}