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=-id&page=191",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=189",
"results": [
{
"id": "jvasp-95023",
"created_at": "2022-09-04T14:35:51.752237Z",
"updated_at": "2022-09-04T14:35:51.752262Z",
"structure_string": "V3 Te4\n1.0\n-0.000000 3.961116 -0.000000\n0.027165 -0.000000 6.889672\n6.208270 -1.980558 -3.283276\nV Te\n3 4\ndirect\n0.000000 0.000000 0.000000 V\n0.743921 0.709350 0.487840 V\n0.256079 0.290649 0.512159 V\n0.635310 0.974047 0.270620 Te\n0.364690 0.025952 0.729379 Te\n0.887857 0.547801 0.775715 Te\n0.112143 0.452197 0.224285 Te\n",
"nsites": 7,
"nelements": 2,
"elements": [
"V",
"Te"
],
"chemical_system": "Te-V",
"density": 6.486617750585359,
"density_atomic": 0.041229368961320546,
"volume": 169.78188549446563,
"volume_molar": 14.606434470655346,
"formula_full": "V3 Te4",
"formula_reduced": "V3Te4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.682769095238095,
"spacegroup": 12
},
{
"id": "jvasp-9502",
"created_at": "2022-09-04T14:37:08.175188Z",
"updated_at": "2022-09-04T14:37:08.175217Z",
"structure_string": "Zn2 Sn2 F8\n1.0\n-5.084812 -0.011071 -0.025164\n-0.023848 -5.490643 -0.010583\n2.315529 2.012220 5.927319\nZn Sn F\n2 2 8\ndirect\n0.251792 0.249129 0.502167 Zn\n0.751801 0.749132 0.502166 Zn\n0.006654 0.511388 0.037151 Sn\n0.496950 0.986797 0.967185 Sn\n0.436514 0.709249 0.187371 F\n0.067065 0.789012 0.816961 F\n0.618010 0.089290 0.629979 F\n0.493164 0.601837 0.632347 F\n0.885628 0.409005 0.374348 F\n0.010424 0.896451 0.371973 F\n0.270963 0.222633 0.193517 F\n0.232693 0.275620 0.810845 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zn",
"Sn",
"F"
],
"chemical_system": "F-Sn-Zn",
"density": 5.2337089994245485,
"density_atomic": 0.07270266204247375,
"volume": 165.0558543920917,
"volume_molar": 8.283246570093672,
"formula_full": "Zn2 Sn2 F8",
"formula_reduced": "ZnSnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-95014",
"created_at": "2022-09-04T14:35:49.230943Z",
"updated_at": "2022-09-04T14:35:49.230967Z",
"structure_string": "Ga2 Ni1 S4\n1.0\n-1.816250 -3.145760 -0.000071\n-1.816146 3.145701 -0.000027\n-0.000328 -0.000086 -12.048910\nGa Ni S\n2 1 4\ndirect\n0.333337 0.666667 0.217459 Ga\n0.666666 0.333334 0.782541 Ga\n0.000001 -0.000000 0.500000 Ni\n0.333337 0.666668 0.869945 S\n0.666666 0.333333 0.130055 S\n0.333310 0.666654 0.402958 S\n0.666693 0.333347 0.597042 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ga",
"Ni",
"S"
],
"chemical_system": "Ga-Ni-S",
"density": 3.9367332412040836,
"density_atomic": 0.050843516271495574,
"volume": 137.67733849526087,
"volume_molar": 11.84446159829468,
"formula_full": "Ga2 Ni1 S4",
"formula_reduced": "Ga2NiS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.1770652928571428,
"spacegroup": 164
},
{
"id": "jvasp-95013",
"created_at": "2022-09-04T14:35:46.833605Z",
"updated_at": "2022-09-04T14:35:46.833628Z",
"structure_string": "Yb1 Fe2 O4\n1.0\n-1.730728 -2.997709 0.000000\n1.730728 -2.997709 0.000000\n-0.000000 -1.998473 8.150391\nYb Fe O\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Yb\n0.214719 0.214719 0.355843 Fe\n0.785281 0.785281 0.644157 Fe\n0.131071 0.131071 0.606788 O\n0.868929 0.868929 0.393212 O\n0.287220 0.287220 0.138340 O\n0.712779 0.712779 0.861660 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Yb",
"Fe",
"O"
],
"chemical_system": "Fe-O-Yb",
"density": 6.847131795656088,
"density_atomic": 0.0827696862622103,
"volume": 84.5720252922591,
"volume_molar": 7.275780580975206,
"formula_full": "Yb1 Fe2 O4",
"formula_reduced": "Yb(FeO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.276966528571428,
"spacegroup": 166
},
{
"id": "jvasp-9501",
"created_at": "2022-09-04T14:37:09.545926Z",
"updated_at": "2022-09-04T14:37:09.545942Z",
"structure_string": "Zn2 Cr2 Si2 O10\n1.0\n5.163559 -0.063407 -0.041709\n-1.225568 5.275725 -0.007075\n-1.835678 -2.374026 6.310064\nZn Cr Si O\n2 2 2 10\ndirect\n0.306311 0.174367 0.794119 Zn\n0.702183 0.815493 0.234959 Zn\n0.004252 0.494918 0.514559 Cr\n0.004248 0.494925 0.014562 Cr\n0.690238 0.831573 0.752487 Si\n0.318267 0.158276 0.276623 Si\n0.742140 0.689270 0.933102 O\n0.947965 0.842619 0.652534 O\n0.266349 0.300582 0.096010 O\n0.060551 0.147213 0.376591 O\n0.629111 0.304879 0.466906 O\n0.323092 0.846224 0.165067 O\n0.379402 0.684940 0.562202 O\n0.685390 0.143623 0.864030 O\n0.896677 0.543878 0.254174 O\n0.111804 0.445963 0.774944 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Zn",
"Cr",
"Si",
"O"
],
"chemical_system": "Cr-O-Si-Zn",
"density": 4.384629399906571,
"density_atomic": 0.09368091348986521,
"volume": 170.79252756999372,
"volume_molar": 6.428354011141769,
"formula_full": "Zn2 Cr2 Si2 O10",
"formula_reduced": "ZnCrSiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.4024892375,
"spacegroup": 2
},
{
"id": "jvasp-95009",
"created_at": "2022-09-04T14:35:44.836559Z",
"updated_at": "2022-09-04T14:35:44.836577Z",
"structure_string": "Li1 Fe2 Cl2 O2\n1.0\n3.892975 -0.000008 -0.000000\n-0.000017 8.052413 0.000034\n0.000000 0.000013 3.429971\nLi Fe Cl O\n1 2 2 2\ndirect\n0.500005 0.463752 0.000009 Li\n0.000000 0.062009 0.499995 Fe\n0.499999 0.902210 -0.000002 Fe\n0.000002 0.303783 -0.000004 Cl\n0.499995 0.659608 0.500004 Cl\n-0.000002 0.918250 0.999997 O\n0.500001 0.050382 0.499996 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cl",
"O"
],
"chemical_system": "Cl-Fe-Li-O",
"density": 3.421329571329613,
"density_atomic": 0.06510284022001103,
"volume": 107.5221906808356,
"volume_molar": 9.25019667290789,
"formula_full": "Li1 Fe2 Cl2 O2",
"formula_reduced": "LiFe2(ClO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 1.8679565907142852,
"spacegroup": 25
},
{
"id": "jvasp-95008",
"created_at": "2022-09-04T14:35:40.818907Z",
"updated_at": "2022-09-04T14:35:40.818925Z",
"structure_string": "K3 Cr1 F3\n1.0\n5.376961 0.602419 3.061823\n2.339625 4.890927 3.024719\n-0.015403 0.016440 6.080502\nK Cr F\n3 1 3\ndirect\n0.226228 0.275379 0.258082 K\n0.479741 0.530292 0.544885 K\n0.734680 0.783771 0.749538 K\n-0.019522 0.029504 0.041099 Cr\n0.194661 0.244057 0.828706 F\n0.978353 0.031624 0.680213 F\n0.765863 0.815376 0.257475 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"K",
"Cr",
"F"
],
"chemical_system": "Cr-F-K",
"density": 2.4820481604001965,
"density_atomic": 0.0462382148635192,
"volume": 151.38992758829073,
"volume_molar": 13.024163622612773,
"formula_full": "K3 Cr1 F3",
"formula_reduced": "K3CrF3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.0907893857142855,
"spacegroup": 44
},
{
"id": "jvasp-95007",
"created_at": "2022-09-04T14:36:21.041689Z",
"updated_at": "2022-09-04T14:36:21.041715Z",
"structure_string": "Cr2 H1 O4\n1.0\n2.449397 0.000000 4.086068\n-0.112973 2.952580 9.228862\n-0.112973 0.000000 9.228862\nCr H O\n2 1 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000001 0.500000 -0.000000 Cr\n0.500002 0.500000 0.499999 H\n0.578966 0.000000 0.611943 O\n0.415781 0.500000 0.407438 O\n0.584223 0.500000 0.592561 O\n0.421037 0.000000 0.388056 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cr",
"H",
"O"
],
"chemical_system": "Cr-H-O",
"density": 4.120421847158551,
"density_atomic": 0.1027802635344128,
"volume": 68.10646090293655,
"volume_molar": 5.859238488898865,
"formula_full": "Cr2 H1 O4",
"formula_reduced": "Cr2HO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.2957969714285715,
"spacegroup": 10
},
{
"id": "jvasp-9500",
"created_at": "2022-09-04T14:37:07.673498Z",
"updated_at": "2022-09-04T14:37:07.673527Z",
"structure_string": "Mg2 Co2 Si2 O10\n1.0\n4.997891 -0.281086 0.146753\n-1.507835 5.174268 -0.047670\n-1.410011 -2.242407 6.058182\nMg Co Si O\n2 2 2 10\ndirect\n0.370271 0.215189 0.772055 Mg\n0.638228 0.774648 0.257045 Mg\n0.004248 0.494919 0.514554 Co\n0.004251 0.494923 0.014554 Co\n0.703536 0.819021 0.760867 Si\n0.304959 0.170819 0.268244 Si\n0.702634 0.632462 0.923986 O\n0.994928 0.851807 0.669019 O\n0.305866 0.357384 0.105122 O\n0.013570 0.138033 0.360088 O\n0.592786 0.289360 0.487845 O\n0.304416 0.865225 0.132074 O\n0.415708 0.700489 0.541266 O\n0.704086 0.124619 0.897036 O\n0.899975 0.555234 0.266335 O\n0.108524 0.434607 0.762773 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Mg",
"Co",
"Si",
"O"
],
"chemical_system": "Co-Mg-O-Si",
"density": 4.096303451995744,
"density_atomic": 0.1031504343724747,
"volume": 155.11325858526428,
"volume_molar": 5.838211730892125,
"formula_full": "Mg2 Co2 Si2 O10",
"formula_reduced": "MgCoSiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.29035825625,
"spacegroup": 2
},
{
"id": "jvasp-95",
"created_at": "2022-09-04T14:37:42.971596Z",
"updated_at": "2022-09-04T14:37:42.971626Z",
"structure_string": "Cd2 S2\n1.0\n2.088763 -3.617842 0.000000\n2.088763 3.617842 0.000000\n0.000000 0.000000 6.819638\nCd S\n2 2\ndirect\n0.666666 0.333332 0.500710 Cd\n0.333332 0.666666 0.000709 Cd\n0.666666 0.333332 0.876291 S\n0.333332 0.666666 0.376291 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"S"
],
"chemical_system": "Cd-S",
"density": 4.655268369203586,
"density_atomic": 0.03880877295136609,
"volume": 103.0694787751386,
"volume_molar": 15.517472731092928,
"formula_full": "Cd2 S2",
"formula_reduced": "CdS",
"formula_anonymous": "AB",
"energy_above_hull": 0.0001299999999999,
"spacegroup": 186
},
{
"id": "jvasp-94997",
"created_at": "2022-09-04T14:36:19.607780Z",
"updated_at": "2022-09-04T14:36:19.607801Z",
"structure_string": "Mn1 Ga2 Se4\n1.0\n5.662805 -0.000000 0.000000\n0.000000 5.662805 0.000000\n-2.831403 -2.831403 5.471810\nMn Ga Se\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 -0.000000 Ga\n0.250000 0.750000 0.500000 Ga\n0.621663 0.133834 0.731155 Se\n0.109492 0.597321 0.731155 Se\n0.866165 0.890507 0.268845 Se\n0.402678 0.378337 0.268845 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Mn",
"Ga",
"Se"
],
"chemical_system": "Ga-Mn-Se",
"density": 4.828539588239736,
"density_atomic": 0.03989365407693133,
"volume": 175.46650368254382,
"volume_molar": 15.095485483447673,
"formula_full": "Mn1 Ga2 Se4",
"formula_reduced": "Mn(GaSe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.3784421940065683,
"spacegroup": 82
},
{
"id": "jvasp-94994",
"created_at": "2022-09-04T14:36:17.785110Z",
"updated_at": "2022-09-04T14:36:17.785146Z",
"structure_string": "Rb2 Ni1 F4\n1.0\n3.943964 -0.000000 -1.126610\n-0.321820 3.930812 -1.126610\n-0.011581 -0.012568 7.426153\nRb Ni F\n2 1 4\ndirect\n0.646928 0.646929 0.293857 Rb\n0.353071 0.353070 0.706142 Rb\n0.000000 0.000000 0.000000 Ni\n0.499999 0.000000 -0.000000 F\n0.000000 0.500000 -0.000000 F\n0.852162 0.852162 0.704326 F\n0.147837 0.147837 0.295674 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Ni",
"F"
],
"chemical_system": "F-Ni-Rb",
"density": 4.4124215052127775,
"density_atomic": 0.06086119156500337,
"volume": 115.01582239847512,
"volume_molar": 9.894878173011113,
"formula_full": "Rb2 Ni1 F4",
"formula_reduced": "Rb2NiF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 139
}
]
}