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&page=1190",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1188",
"results": [
{
"id": "jvasp-65300",
"created_at": "2022-09-04T14:35:48.228562Z",
"updated_at": "2022-09-04T14:35:48.228582Z",
"structure_string": "Ca4 Be1 Pt1\n1.0\n-0.000000 4.226766 4.226766\n4.226766 0.000000 4.226766\n4.226766 4.226766 0.000000\nCa Be Pt\n4 1 1\ndirect\n0.127796 0.624069 0.624069 Ca\n0.624069 0.624069 0.624069 Ca\n0.624069 0.127796 0.624069 Ca\n0.624069 0.624069 0.127796 Ca\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Pt"
],
"chemical_system": "Be-Ca-Pt",
"density": 4.0066610618421485,
"density_atomic": 0.03972799419804932,
"volume": 151.02700554397998,
"volume_molar": 15.158431432452465,
"formula_full": "Ca4 Be1 Pt1",
"formula_reduced": "Ca4BePt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6079898633333336,
"spacegroup": 216
},
{
"id": "jvasp-119267",
"created_at": "2022-09-04T14:38:46.979799Z",
"updated_at": "2022-09-04T14:38:46.979830Z",
"structure_string": "Mn4 O2 F8\n1.0\n2.996890 -0.350087 -0.000513\n-2.235947 5.028391 -0.000126\n0.002410 0.001283 11.711808\nMn O F\n4 2 8\ndirect\n-0.104976 0.118296 0.206812 Mn\n0.212456 0.469006 0.903576 Mn\n0.787578 0.530996 0.403578 Mn\n0.104975 0.881714 0.706818 Mn\n0.407928 0.671589 0.764153 O\n0.592060 0.328404 0.264153 O\n0.042243 0.284651 0.045925 F\n0.043400 0.300377 0.452671 F\n0.177656 0.885042 0.157970 F\n0.575248 0.789562 0.346212 F\n0.424750 0.210419 0.846209 F\n0.822328 0.114952 0.657970 F\n0.957791 0.715362 0.545926 F\n0.956627 0.699620 0.952674 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.0067409984692315,
"density_atomic": 0.08367011379508753,
"volume": 167.3237834274581,
"volume_molar": 7.197481259256485,
"formula_full": "Mn4 O2 F8",
"formula_reduced": "Mn2OF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.350297016108374,
"spacegroup": 4
},
{
"id": "jvasp-97682",
"created_at": "2022-09-04T14:38:08.322655Z",
"updated_at": "2022-09-04T14:38:08.322671Z",
"structure_string": "Na8 Ge8 Se20\n1.0\n6.212734 0.000000 0.000000\n0.000000 11.277605 0.000000\n0.000000 0.000000 13.865721\nNa Ge Se\n8 8 20\ndirect\n0.997696 0.495859 0.060784 Na\n0.002303 0.995859 0.939216 Na\n0.502303 0.495859 0.560784 Na\n0.497697 0.995859 0.439216 Na\n0.997530 0.247088 0.461831 Na\n0.002469 0.747088 0.538169 Na\n0.502469 0.247088 0.961831 Na\n0.497530 0.747088 0.038169 Na\n0.545217 0.701136 0.347179 Ge\n0.454783 0.201137 0.652821 Ge\n0.954782 0.701136 0.847179 Ge\n0.045217 0.201137 0.152821 Ge\n0.962157 0.392989 0.704946 Ge\n0.462157 0.892989 0.795054 Ge\n0.537842 0.392989 0.204946 Ge\n0.037842 0.892989 0.295054 Ge\n0.092022 0.857244 0.741164 Se\n0.499919 0.983507 0.944432 Se\n0.500080 0.483507 0.055568 Se\n0.001226 0.246749 0.990364 Se\n0.998774 0.746749 0.009636 Se\n0.498774 0.246749 0.490364 Se\n0.501225 0.746749 0.509636 Se\n0.907977 0.357244 0.258836 Se\n0.592022 0.357244 0.758836 Se\n0.612116 0.004628 0.661739 Se\n0.411633 0.187997 0.211630 Se\n0.588367 0.687997 0.788370 Se\n0.088367 0.187997 0.711630 Se\n0.911633 0.687997 0.288370 Se\n0.887883 0.004628 0.161739 Se\n0.112116 0.504628 0.838261 Se\n-0.000080 0.483507 0.555567 Se\n0.387883 0.504628 0.338261 Se\n0.407977 0.857244 0.241164 Se\n0.000080 0.983507 0.444432 Se\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Na",
"Ge",
"Se"
],
"chemical_system": "Ge-Na-Se",
"density": 4.006902099724007,
"density_atomic": 0.037056159296264705,
"volume": 971.4984143979766,
"volume_molar": 16.25138944339285,
"formula_full": "Na8 Ge8 Se20",
"formula_reduced": "Na2Ge2Se5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 0.868499637037037,
"spacegroup": 33
},
{
"id": "jvasp-20656",
"created_at": "2022-09-04T14:38:08.420426Z",
"updated_at": "2022-09-04T14:38:08.420455Z",
"structure_string": "Ce1 Al4\n1.0\n3.954320 0.000000 -1.568845\n-0.622426 3.905027 -1.568845\n0.256749 0.300912 6.415058\nCe Al\n1 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.249999 0.750000 0.500001 Al\n0.750000 0.250000 0.500001 Al\n0.389235 0.389235 0.778472 Al\n0.610764 0.610765 0.221530 Al\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ce",
"Al"
],
"chemical_system": "Al-Ce",
"density": 4.006918722785899,
"density_atomic": 0.04864138643934266,
"volume": 102.79312260630476,
"volume_molar": 12.380693069902106,
"formula_full": "Ce1 Al4",
"formula_reduced": "CeAl4",
"formula_anonymous": "AB4",
"energy_above_hull": 1.8360113400000004,
"spacegroup": 139
},
{
"id": "jvasp-119292",
"created_at": "2022-09-04T14:38:29.730484Z",
"updated_at": "2022-09-04T14:38:29.730516Z",
"structure_string": "V2 Mo2 O10\n1.0\n4.290195 0.000000 0.000001\n-0.000003 6.620431 -0.000002\n-0.000000 0.000001 6.620430\nV Mo O\n2 2 10\ndirect\n0.841680 0.250000 0.250001 V\n0.158322 0.750000 0.750000 V\n0.500002 0.250000 0.750000 Mo\n0.500002 0.750000 0.250000 Mo\n0.742508 0.227866 0.967549 O\n0.742508 0.532451 0.227866 O\n0.742508 0.967549 0.272134 O\n0.742508 0.272134 0.532451 O\n0.221447 0.250000 0.250000 O\n0.778554 0.750000 0.750000 O\n0.257494 0.727866 0.467547 O\n0.257494 0.032454 0.727866 O\n0.257494 0.467546 0.772134 O\n0.257494 0.772134 0.032454 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Mo",
"O"
],
"chemical_system": "Mo-O-V",
"density": 4.007033205452193,
"density_atomic": 0.07445237253021492,
"volume": 188.0396758923753,
"volume_molar": 8.088581404919019,
"formula_full": "V2 Mo2 O10",
"formula_reduced": "VMoO5",
"formula_anonymous": "ABC5",
"energy_above_hull": 3.324796800000001,
"spacegroup": 85
},
{
"id": "jvasp-109734",
"created_at": "2022-09-04T14:38:12.872620Z",
"updated_at": "2022-09-04T14:38:12.872648Z",
"structure_string": "In1 Cu1 Ge1 S4\n1.0\n5.026793 0.043496 -4.028562\n-1.132208 4.897820 -4.028562\n-0.034282 -0.043496 6.441799\nIn Cu Ge S\n1 1 1 4\ndirect\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.000000 Cu\n0.750000 0.250000 0.500000 Ge\n0.373916 0.369749 0.469804 S\n0.899944 0.904113 0.530196 S\n0.630250 0.100056 0.004168 S\n0.095888 0.626083 0.995832 S\n",
"nsites": 7,
"nelements": 4,
"elements": [
"In",
"Cu",
"Ge",
"S"
],
"chemical_system": "Cu-Ge-In-S",
"density": 4.0070974864581865,
"density_atomic": 0.04453866852003581,
"volume": 157.1667998303774,
"volume_molar": 13.52115130538967,
"formula_full": "In1 Cu1 Ge1 S4",
"formula_reduced": "InCuGeS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.1479966242857145,
"spacegroup": 82
},
{
"id": "jvasp-42479",
"created_at": "2022-09-04T14:36:52.772472Z",
"updated_at": "2022-09-04T14:36:52.772491Z",
"structure_string": "Cr4 S6\n1.0\n3.293457 -4.857257 -0.000000\n1.935061 4.857256 -2.665033\n1.961308 4.875053 3.847884\nCr S\n4 6\ndirect\n0.323534 0.676467 0.970600 Cr\n0.500001 0.500000 0.500002 Cr\n-0.000002 0.000002 -0.000005 Cr\n0.676471 0.323530 0.029411 Cr\n0.092917 0.596412 0.242247 S\n0.596415 0.745747 0.757750 S\n0.403589 0.254258 0.242247 S\n0.907085 0.403586 0.757750 S\n0.254254 0.092916 0.757750 S\n0.745742 0.907083 0.242248 S\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Cr",
"S"
],
"chemical_system": "Cr-S",
"density": 4.0074667110946445,
"density_atomic": 0.060277401935703766,
"volume": 165.8996519237296,
"volume_molar": 9.990710559197046,
"formula_full": "Cr4 S6",
"formula_reduced": "Cr2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.114368960000001,
"spacegroup": 148
},
{
"id": "jvasp-97812",
"created_at": "2022-09-04T14:35:51.952653Z",
"updated_at": "2022-09-04T14:35:51.952674Z",
"structure_string": "Sb8 S12 O48\n1.0\n4.748635 0.000000 0.000000\n0.000000 12.822982 -2.465643\n0.000000 0.035462 14.465743\nSb S O\n8 12 48\ndirect\n0.412412 0.924813 0.283625 Sb\n0.310036 0.826678 0.933100 Sb\n0.810036 0.673322 0.566900 Sb\n0.689965 0.173322 0.066900 Sb\n0.912412 0.575187 0.216375 Sb\n0.087589 0.424813 0.783625 Sb\n0.587589 0.075187 0.716375 Sb\n0.189965 0.326678 0.433100 Sb\n0.863461 0.942164 0.108713 S\n0.363461 0.557836 0.391288 S\n0.636540 0.442164 0.608712 S\n0.825149 0.651246 0.821957 S\n0.325149 0.848754 0.678043 S\n0.136540 0.057836 0.891287 S\n0.674852 0.151246 0.321957 S\n0.558372 0.335903 0.895318 S\n0.058371 0.164097 0.604682 S\n0.441629 0.664097 0.104682 S\n0.941630 0.835903 0.395318 S\n0.174852 0.348754 0.178043 S\n0.400142 0.436614 0.900016 O\n0.547227 0.136399 0.227869 O\n0.047226 0.363600 0.272131 O\n0.452774 0.863600 0.772131 O\n0.952775 0.636399 0.727869 O\n0.569596 0.063311 0.369528 O\n0.930405 0.563311 0.869528 O\n0.430405 0.936689 0.630472 O\n0.570507 0.251159 0.384164 O\n0.070507 0.248841 0.115836 O\n0.429494 0.748841 0.615836 O\n0.900143 0.063386 0.599983 O\n0.069596 0.436689 0.130472 O\n0.018638 0.842277 0.677512 O\n0.863769 0.935729 0.211274 O\n0.543346 0.303097 0.986839 O\n0.363769 0.564271 0.288726 O\n0.136232 0.064270 0.788726 O\n0.636232 0.435729 0.711274 O\n0.044454 0.853971 0.060806 O\n0.544454 0.646029 0.439194 O\n0.955547 0.146029 0.939194 O\n0.455547 0.353971 0.560806 O\n0.572522 0.934695 0.073202 O\n0.072522 0.565305 0.426798 O\n0.427479 0.065305 0.926798 O\n0.927479 0.434695 0.573202 O\n0.990306 0.043851 0.096841 O\n0.490305 0.456149 0.403159 O\n0.009695 0.956149 0.903159 O\n0.099858 0.936614 0.400017 O\n0.509696 0.543851 0.596841 O\n0.518638 0.657723 0.822488 O\n0.481363 0.342277 0.177512 O\n0.981363 0.157723 0.322488 O\n0.057765 0.760123 0.316251 O\n0.557766 0.739877 0.183749 O\n0.942236 0.239877 0.683749 O\n0.442235 0.260123 0.816251 O\n0.629788 0.854683 0.379574 O\n0.129788 0.645316 0.120426 O\n0.370213 0.145316 0.620426 O\n0.870213 0.354683 0.879574 O\n0.956655 0.803097 0.486839 O\n0.456655 0.696903 0.013161 O\n0.043346 0.196903 0.513161 O\n0.929494 0.751159 0.884164 O\n0.599859 0.563386 0.099983 O\n",
"nsites": 68,
"nelements": 3,
"elements": [
"Sb",
"S",
"O"
],
"chemical_system": "O-S-Sb",
"density": 4.007549425512362,
"density_atomic": 0.07716239159447301,
"volume": 881.2583253947602,
"volume_molar": 7.804502472719307,
"formula_full": "Sb8 S12 O48",
"formula_reduced": "Sb2(SO4)3",
"formula_anonymous": "A2B3C12",
"energy_above_hull": 2.7072061294117646,
"spacegroup": 14
},
{
"id": "jvasp-120591",
"created_at": "2022-09-04T14:38:51.522193Z",
"updated_at": "2022-09-04T14:38:51.522220Z",
"structure_string": "Li3 Fe3 O8\n1.0\n4.949538 0.045802 2.981427\n1.706825 4.646157 2.981427\n0.064978 0.045802 5.777769\nLi Fe O\n3 3 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.379216 0.379216 0.379216 Li\n0.620784 0.620784 0.620785 Li\n-0.000001 0.500000 0.000000 Fe\n0.500000 -0.000000 0.000000 Fe\n0.000000 -0.000000 0.500000 Fe\n0.249196 0.249196 0.789809 O\n0.789809 0.249196 0.249197 O\n0.249195 0.789809 0.249197 O\n0.761705 0.761705 0.761706 O\n0.750804 0.750804 0.210192 O\n0.210191 0.750804 0.750805 O\n0.750804 0.210191 0.750805 O\n0.238295 0.238295 0.238295 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 4.007550460681261,
"density_atomic": 0.10680355431685802,
"volume": 131.08177990468076,
"volume_molar": 5.638520926123764,
"formula_full": "Li3 Fe3 O8",
"formula_reduced": "Li3Fe3O8",
"formula_anonymous": "A3B3C8",
"energy_above_hull": 2.6733074642857138,
"spacegroup": 166
},
{
"id": "jvasp-113570",
"created_at": "2022-09-04T14:38:48.006218Z",
"updated_at": "2022-09-04T14:38:48.006234Z",
"structure_string": "Ca1 Zr1 S1\n1.0\n4.890955 0.000000 -0.000000\n-2.445477 4.235691 0.000000\n0.000000 0.000000 3.267346\nCa Zr S\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666666 0.333333 0.000000 Zr\n0.333333 0.666667 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Zr",
"S"
],
"chemical_system": "Ca-S-Zr",
"density": 4.007747640272027,
"density_atomic": 0.04432086118117479,
"volume": 67.68821543734455,
"volume_molar": 13.587598705229796,
"formula_full": "Ca1 Zr1 S1",
"formula_reduced": "CaZrS",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6985783066666666,
"spacegroup": 187
},
{
"id": "jvasp-119526",
"created_at": "2022-09-04T14:38:34.896748Z",
"updated_at": "2022-09-04T14:38:34.896760Z",
"structure_string": "Cr2 Sb2 P4 O16\n1.0\n10.853480 -0.000772 -1.322618\n0.000403 5.771929 -0.000059\n-0.131450 0.000072 4.826818\nCr Sb P O\n2 2 4 16\ndirect\n0.198694 0.750001 0.434705 Cr\n0.801305 0.249999 0.565294 Cr\n0.265614 0.250001 0.978924 Sb\n0.734385 0.749999 0.021076 Sb\n0.066277 0.249999 0.377510 P\n0.377019 0.750002 0.900814 P\n0.622981 0.249997 0.099185 P\n0.933723 0.750001 0.622489 P\n0.876062 0.964450 0.757641 O\n0.876063 0.535549 0.757641 O\n0.690106 0.457154 0.288252 O\n0.690106 0.042843 0.288252 O\n0.669552 0.249998 0.814937 O\n0.513777 0.750001 0.909567 O\n0.486223 0.249999 0.090433 O\n0.123937 0.464452 0.242358 O\n0.309893 0.542846 0.711747 O\n0.309893 0.957158 0.711747 O\n0.894668 0.750000 0.302200 O\n0.123937 0.035549 0.242359 O\n0.105332 0.250000 0.697802 O\n0.074726 0.750002 0.685642 O\n0.330448 0.750001 0.185064 O\n0.925273 0.249999 0.314358 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cr",
"Sb",
"P",
"O"
],
"chemical_system": "Cr-O-P-Sb",
"density": 4.007871178327353,
"density_atomic": 0.07963500390809704,
"volume": 301.3750087549095,
"volume_molar": 7.562178017784572,
"formula_full": "Cr2 Sb2 P4 O16",
"formula_reduced": "CrSb(PO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.047381875,
"spacegroup": 11
},
{
"id": "jvasp-16652",
"created_at": "2022-09-04T14:37:57.470004Z",
"updated_at": "2022-09-04T14:37:57.470021Z",
"structure_string": "Co1 Si1 Cu2 S4\n1.0\n4.734308 -0.000000 -2.151971\n-0.978174 4.632154 -2.151971\n0.055151 0.068014 6.405027\nCo Si Cu S\n1 1 2 4\ndirect\n0.000000 0.000000 0.000000 Co\n0.500001 0.500000 0.000000 Si\n0.750000 0.249999 0.500000 Cu\n0.250000 0.749999 0.500000 Cu\n0.138810 0.621944 0.760755 S\n0.621945 0.138809 0.760755 S\n0.861192 0.861190 0.239246 S\n0.378055 0.378054 0.239246 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Co",
"Si",
"Cu",
"S"
],
"chemical_system": "Co-Cu-S-Si",
"density": 4.007940707810049,
"density_atomic": 0.05639824543629744,
"volume": 141.84838443309562,
"volume_molar": 10.677886720433683,
"formula_full": "Co1 Si1 Cu2 S4",
"formula_reduced": "CoCu2SiS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.8592088,
"spacegroup": 121
}
]
}