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=volume&page=3449",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=3447",
"results": [
{
"id": "jvasp-54904",
"created_at": "2022-09-04T14:38:36.124550Z",
"updated_at": "2022-09-04T14:38:36.124576Z",
"structure_string": "Sr3 Al2 Ge4\n1.0\n4.209211 -0.000000 -0.000000\n-2.104605 5.928467 -2.226437\n-0.000000 -0.002400 8.949652\nSr Al Ge\n3 2 4\ndirect\n0.393753 0.787509 0.312396 Sr\n0.000000 0.000000 0.000000 Sr\n0.606246 0.212492 0.687604 Sr\n0.295418 0.590837 0.649612 Al\n0.704581 0.409163 0.350388 Al\n0.290026 0.580055 0.944934 Ge\n0.709973 0.419946 0.055065 Ge\n0.104720 0.209441 0.390711 Ge\n0.895278 0.790560 0.609289 Ge\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sr",
"Al",
"Ge"
],
"chemical_system": "Al-Ge-Sr",
"density": 4.516544287672169,
"density_atomic": 0.04030296501761294,
"volume": 223.30863240624797,
"volume_molar": 14.942177969705808,
"formula_full": "Sr3 Al2 Ge4",
"formula_reduced": "Sr3(AlGe2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 0.57690537,
"spacegroup": 12
},
{
"id": "jvasp-48342",
"created_at": "2022-09-04T14:36:17.861564Z",
"updated_at": "2022-09-04T14:36:17.861592Z",
"structure_string": "Mn6 O2 F10\n1.0\n4.796279 -0.083475 0.008810\n-0.083475 4.796279 0.008810\n0.018835 0.018835 9.710743\nMn O F\n6 2 10\ndirect\n0.964012 0.964012 0.003356 Mn\n0.035990 0.035990 0.329977 Mn\n0.000001 0.000001 0.666667 Mn\n0.503516 0.503516 0.844900 Mn\n0.500001 0.500001 0.166667 Mn\n0.496486 0.496486 0.488434 Mn\n0.325987 0.325987 0.324759 O\n0.674015 0.674015 0.008574 O\n0.796769 0.203233 0.166667 F\n0.690558 0.690558 0.658819 F\n0.726247 0.726247 0.330896 F\n0.309444 0.309444 0.674513 F\n0.203233 0.796769 0.166667 F\n0.182115 0.787392 0.833844 F\n0.212610 0.817887 0.499490 F\n0.817887 0.212610 0.499490 F\n0.273755 0.273755 0.002437 F\n0.787392 0.182115 0.833844 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.101620525526656,
"density_atomic": 0.08060201276234068,
"volume": 223.31948524752053,
"volume_molar": 7.471452081173957,
"formula_full": "Mn6 O2 F10",
"formula_reduced": "Mn3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.634642959626437,
"spacegroup": 12
},
{
"id": "jvasp-123778",
"created_at": "2022-09-04T14:38:55.414514Z",
"updated_at": "2022-09-04T14:38:55.414548Z",
"structure_string": "Ac1 Bi5\n1.0\n2.368842 -4.102966 0.000000\n2.368842 4.102966 -0.000000\n0.000000 -0.000000 11.488933\nAc Bi\n1 5\ndirect\n0.000000 0.000000 0.249999 Ac\n0.666666 0.333333 0.069744 Bi\n0.666666 0.333333 0.589336 Bi\n0.333333 0.666666 0.430289 Bi\n0.333333 0.666666 0.910637 Bi\n0.000000 0.000000 0.749994 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ac",
"Bi"
],
"chemical_system": "Ac-Bi",
"density": 9.457123109583199,
"density_atomic": 0.026866280532733038,
"volume": 223.32827176020095,
"volume_molar": 22.415238137124387,
"formula_full": "Ac1 Bi5",
"formula_reduced": "AcBi5",
"formula_anonymous": "AB5",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-66583",
"created_at": "2022-09-04T14:36:03.768680Z",
"updated_at": "2022-09-04T14:36:03.768707Z",
"structure_string": "Ba4 Sc1 Ir1\n1.0\n-0.000000 4.815606 4.815606\n4.815606 0.000000 4.815606\n4.815606 4.815606 -0.000000\nBa Sc Ir\n4 1 1\ndirect\n0.128847 0.623718 0.623718 Ba\n0.623718 0.623718 0.623718 Ba\n0.623718 0.128847 0.623718 Ba\n0.623718 0.623718 0.128847 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Ir"
],
"chemical_system": "Ba-Ir-Sc",
"density": 5.847287500454547,
"density_atomic": 0.02686385991076267,
"volume": 223.3483952019931,
"volume_molar": 22.41725790710852,
"formula_full": "Ba4 Sc1 Ir1",
"formula_reduced": "Ba4ScIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3158733716666662,
"spacegroup": 216
},
{
"id": "jvasp-36458",
"created_at": "2022-09-04T14:37:27.731834Z",
"updated_at": "2022-09-04T14:37:27.731865Z",
"structure_string": "Sr3 Sb1 As1\n1.0\n6.067802 -0.000000 -0.000000\n0.000000 6.067802 -0.000000\n-0.000000 0.000000 6.067802\nSr Sb As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Sb",
"As"
],
"chemical_system": "As-Sb-Sr",
"density": 3.4157000584427357,
"density_atomic": 0.02238081008660682,
"volume": 223.4056756950059,
"volume_molar": 26.907608512364725,
"formula_full": "Sr3 Sb1 As1",
"formula_reduced": "Sr3SbAs",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.378661356,
"spacegroup": 221
},
{
"id": "jvasp-110784",
"created_at": "2022-09-04T14:38:47.851372Z",
"updated_at": "2022-09-04T14:38:47.851396Z",
"structure_string": "Er6 Mg2\n1.0\n6.880195 0.000000 0.000000\n-3.440098 5.958423 0.000000\n-0.000000 -0.000000 5.449569\nEr Mg\n6 2\ndirect\n0.169139 0.338277 0.250000 Er\n0.169138 0.830861 0.250000 Er\n0.661722 0.830861 0.250000 Er\n0.338277 0.169139 0.750000 Er\n0.830860 0.169139 0.750000 Er\n0.830860 0.661723 0.750000 Er\n0.666666 0.333333 0.250000 Mg\n0.333333 0.666666 0.750000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Er",
"Mg"
],
"chemical_system": "Er-Mg",
"density": 7.820568084189401,
"density_atomic": 0.03580929348841259,
"volume": 223.40569222871414,
"volume_molar": 16.817256564831933,
"formula_full": "Er6 Mg2",
"formula_reduced": "Er3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9931120833333332,
"spacegroup": 194
},
{
"id": "jvasp-86025",
"created_at": "2022-09-04T14:36:06.348479Z",
"updated_at": "2022-09-04T14:36:06.348489Z",
"structure_string": "Mn2 V2 Bi2 O10\n1.0\n5.071000 0.015877 -1.672564\n-1.520114 6.324857 -2.366398\n-0.048005 -0.004578 6.978113\nMn V Bi O\n2 2 2 10\ndirect\n0.324533 0.361696 0.224934 Mn\n0.675469 0.638305 0.775066 Mn\n0.654902 0.182090 0.885174 V\n0.345100 0.817911 0.114827 V\n0.089230 0.758414 0.524609 Bi\n0.910772 0.241587 0.475391 Bi\n0.228614 0.649589 0.224760 O\n0.429389 0.086113 0.293951 O\n0.632609 0.757791 0.073511 O\n0.570613 0.913888 0.706050 O\n0.727925 0.500445 0.444635 O\n0.771388 0.350412 0.775240 O\n0.915694 0.217065 0.132953 O\n0.084309 0.782936 0.867047 O\n0.367393 0.242210 0.926489 O\n0.272077 0.499556 0.555365 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Mn",
"V",
"Bi",
"O"
],
"chemical_system": "Bi-Mn-O-V",
"density": 5.869776561706224,
"density_atomic": 0.07161808071337719,
"volume": 223.40727146868986,
"volume_molar": 8.408687722449889,
"formula_full": "Mn2 V2 Bi2 O10",
"formula_reduced": "MnVBiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.890727905172414,
"spacegroup": 2
},
{
"id": "jvasp-92236",
"created_at": "2022-09-04T14:36:16.394705Z",
"updated_at": "2022-09-04T14:36:16.394718Z",
"structure_string": "Cu4 I4\n1.0\n3.503002 0.000000 2.477394\n-0.000314 8.580513 14.865305\n-0.000157 0.000000 7.432653\nCu I\n4 4\ndirect\n0.805091 0.000046 0.731586 Cu\n0.805092 0.249954 0.731769 Cu\n0.804374 0.499940 0.731980 Cu\n0.804374 0.750060 0.731738 Cu\n0.054887 -0.000022 0.981765 I\n0.054887 0.250022 0.981675 I\n0.054346 0.500022 0.981798 I\n0.054346 0.749977 0.981889 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 5.66222539300996,
"density_atomic": 0.03580848957037081,
"volume": 223.4107077953793,
"volume_molar": 16.817634120437543,
"formula_full": "Cu4 I4",
"formula_reduced": "CuI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-86623",
"created_at": "2022-09-04T14:36:11.104277Z",
"updated_at": "2022-09-04T14:36:11.104298Z",
"structure_string": "Mn2 V2 Bi2 O10\n1.0\n5.071001 0.015898 -1.672009\n-1.520523 6.324554 -2.366871\n-0.047162 -0.004790 6.978407\nMn V Bi O\n2 2 2 10\ndirect\n0.324567 0.361722 0.224961 Mn\n0.675434 0.638278 0.775039 Mn\n0.654958 0.182086 0.885163 V\n0.345043 0.817913 0.114838 V\n0.089288 0.758457 0.524713 Bi\n0.910712 0.241542 0.475287 Bi\n0.228600 0.649601 0.224797 O\n0.429321 0.086137 0.293957 O\n0.632548 0.757811 0.073480 O\n0.570679 0.913862 0.706043 O\n0.727929 0.500436 0.444630 O\n0.771400 0.350399 0.775203 O\n0.915725 0.217086 0.132916 O\n0.084276 0.782914 0.867084 O\n0.367453 0.242188 0.926520 O\n0.272071 0.499564 0.555370 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Mn",
"V",
"Bi",
"O"
],
"chemical_system": "Bi-Mn-O-V",
"density": 5.869644903035299,
"density_atomic": 0.07161647432491902,
"volume": 223.4122825903032,
"volume_molar": 8.408876332948145,
"formula_full": "Mn2 V2 Bi2 O10",
"formula_reduced": "MnVBiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.8907029051724136,
"spacegroup": 2
},
{
"id": "jvasp-42091",
"created_at": "2022-09-04T14:37:45.082361Z",
"updated_at": "2022-09-04T14:37:45.082380Z",
"structure_string": "Pa2 Te6\n1.0\n3.384384 -5.861924 0.000000\n3.384384 5.861924 0.000000\n-0.000000 -0.000000 5.630697\nPa Te\n2 6\ndirect\n0.666666 0.333333 0.750000 Pa\n0.333333 0.666666 0.250000 Pa\n0.823617 0.176382 0.250000 Te\n0.823617 0.647234 0.250000 Te\n0.352765 0.176382 0.250000 Te\n0.176382 0.823617 0.750000 Te\n0.176382 0.352765 0.750000 Te\n0.647234 0.823617 0.750000 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pa",
"Te"
],
"chemical_system": "Pa-Te",
"density": 9.124716780045953,
"density_atomic": 0.03580783115093262,
"volume": 223.4148157781301,
"volume_molar": 16.817943356067104,
"formula_full": "Pa2 Te6",
"formula_reduced": "PaTe3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.7679041000000002,
"spacegroup": 194
},
{
"id": "jvasp-8759",
"created_at": "2022-09-04T14:36:33.244421Z",
"updated_at": "2022-09-04T14:36:33.244449Z",
"structure_string": "Cu4 I4\n1.0\n14.290092 0.005089 0.002983\n13.647199 4.238009 0.002983\n13.647199 2.072728 3.696556\nCu I\n4 4\ndirect\n0.270272 0.270272 0.270272 Cu\n0.437431 0.437432 0.437431 Cu\n0.687068 0.687069 0.687068 Cu\n0.853973 0.853975 0.853973 Cu\n0.208256 0.208257 0.208256 I\n0.375103 0.375104 0.375103 I\n0.624873 0.624874 0.624873 I\n0.791823 0.791824 0.791823 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 5.661582038673415,
"density_atomic": 0.03580442093207911,
"volume": 223.43609508937396,
"volume_molar": 16.819545193661934,
"formula_full": "Cu4 I4",
"formula_reduced": "CuI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0008299999999999,
"spacegroup": 160
},
{
"id": "jvasp-87091",
"created_at": "2022-09-04T14:35:49.572557Z",
"updated_at": "2022-09-04T14:35:49.572586Z",
"structure_string": "K3 Na1 Se2 O8\n1.0\n5.861395 0.000000 -0.000000\n-2.930697 5.076116 -0.000000\n-0.000000 -0.000000 7.509885\nK Na Se O\n3 1 2 8\ndirect\n0.000000 0.000000 0.500000 K\n0.666666 0.333333 0.159473 K\n0.333333 0.666667 0.840527 K\n0.000000 0.000000 0.000000 Na\n0.666666 0.333333 0.719469 Se\n0.333333 0.666667 0.280530 Se\n0.358760 0.179380 0.801036 O\n0.820619 0.179380 0.801036 O\n0.820619 0.641241 0.801036 O\n0.179380 0.820621 0.198963 O\n0.641240 0.820621 0.198963 O\n0.179380 0.358760 0.198963 O\n0.333333 0.666667 0.500477 O\n0.666666 0.333333 0.499522 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"Na",
"Se",
"O"
],
"chemical_system": "K-Na-O-Se",
"density": 3.167353929256793,
"density_atomic": 0.06265593589353623,
"volume": 223.44251666415985,
"volume_molar": 9.611444908001545,
"formula_full": "K3 Na1 Se2 O8",
"formula_reduced": "K3Na(SeO4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 1.5328212666666663,
"spacegroup": 164
}
]
}