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=nelements&page=3666",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3664",
"results": [
{
"id": "jvasp-50527",
"created_at": "2022-09-04T14:37:08.464972Z",
"updated_at": "2022-09-04T14:37:08.464995Z",
"structure_string": "Li12 Bi4 O12\n1.0\n-4.438181 4.438181 4.438181\n4.438181 -4.438181 4.438181\n4.438181 4.438181 -4.438181\nLi Bi O\n12 4 12\ndirect\n0.706289 0.462457 0.000000 Li\n0.706289 0.000000 0.462457 Li\n0.756168 0.293711 0.293711 Li\n0.537543 0.537543 0.243832 Li\n0.537543 0.243832 0.537543 Li\n0.462457 0.706289 0.000000 Li\n0.462457 0.000000 0.706289 Li\n0.293711 0.293711 0.756168 Li\n0.293711 0.756168 0.293711 Li\n0.243832 0.537543 0.537543 Li\n0.000000 0.706289 0.462457 Li\n0.000000 0.462457 0.706289 Li\n0.718432 0.718432 0.718432 Bi\n0.000000 0.000000 0.281568 Bi\n0.000000 0.281568 0.000000 Bi\n0.281568 0.000000 0.000000 Bi\n0.503384 0.245912 0.000000 O\n0.503384 0.000000 0.245912 O\n0.754088 0.257472 0.754088 O\n0.754088 0.754088 0.257472 O\n0.245912 0.503384 0.000000 O\n0.245912 0.000000 0.503384 O\n0.742527 0.496615 0.496615 O\n0.000000 0.503384 0.245912 O\n0.000000 0.245912 0.503384 O\n0.496615 0.742527 0.496615 O\n0.496615 0.496615 0.742527 O\n0.257472 0.754088 0.754088 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Bi",
"O"
],
"chemical_system": "Bi-Li-O",
"density": 5.276777845825671,
"density_atomic": 0.0800724303620115,
"volume": 349.68340380591155,
"volume_molar": 7.520866711268282,
"formula_full": "Li12 Bi4 O12",
"formula_reduced": "Li3BiO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.4131678285714284,
"spacegroup": 217
},
{
"id": "jvasp-24685",
"created_at": "2022-09-04T14:37:08.373884Z",
"updated_at": "2022-09-04T14:37:08.373903Z",
"structure_string": "Ca6 C6 Cl4\n1.0\n3.830388 -0.000000 -0.000000\n-1.915194 6.688267 0.000000\n0.000000 0.000000 11.515493\nCa C Cl\n6 6 4\ndirect\n0.344094 0.688187 0.560586 Ca\n0.655908 0.311814 0.439414 Ca\n0.655908 0.311814 0.060586 Ca\n0.344094 0.688187 0.939414 Ca\n0.878902 0.757801 0.250000 Ca\n0.121100 0.242199 0.750000 Ca\n0.733109 0.466217 0.635279 C\n0.266893 0.533784 0.364721 C\n0.266893 0.533784 0.135279 C\n0.733109 0.466217 0.864721 C\n0.256521 0.513042 0.250000 C\n0.743480 0.486958 0.750000 C\n0.470529 0.941055 0.750000 Cl\n0.529473 0.058945 0.250000 Cl\n0.000000 0.000000 0.000000 Cl\n0.000000 0.000000 0.500000 Cl\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"C",
"Cl"
],
"chemical_system": "C-Ca-Cl",
"density": 2.557379502233101,
"density_atomic": 0.05423517886046285,
"volume": 295.0114729254431,
"volume_molar": 11.10375384857467,
"formula_full": "Ca6 C6 Cl4",
"formula_reduced": "Ca3C3Cl2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 2.324932424375,
"spacegroup": 63
},
{
"id": "jvasp-7893",
"created_at": "2022-09-04T14:37:08.375864Z",
"updated_at": "2022-09-04T14:37:08.375889Z",
"structure_string": "Na1 W1 O3\n1.0\n3.911710 0.000000 -0.000000\n0.000000 3.911710 0.000000\n-0.000000 0.000000 3.911710\nNa W O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 W\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"W",
"O"
],
"chemical_system": "Na-O-W",
"density": 7.069622756573647,
"density_atomic": 0.08353530323847361,
"volume": 59.8549332576932,
"volume_molar": 7.209096665164676,
"formula_full": "Na1 W1 O3",
"formula_reduced": "NaWO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.6127939,
"spacegroup": 221
},
{
"id": "jvasp-22586",
"created_at": "2022-09-04T14:37:08.377413Z",
"updated_at": "2022-09-04T14:37:08.377450Z",
"structure_string": "Rb2 Ni1 F6\n1.0\n5.145496 -0.000000 2.970754\n1.715166 4.851220 2.970754\n-0.000000 0.000000 5.941507\nRb Ni F\n2 1 6\ndirect\n0.750001 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Ni\n0.215652 0.784349 0.784348 F\n0.215652 0.784349 0.215650 F\n0.784350 0.215651 0.784348 F\n0.784350 0.215651 0.215650 F\n0.784350 0.784349 0.215650 F\n0.215651 0.215651 0.784349 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Ni",
"F"
],
"chemical_system": "F-Ni-Rb",
"density": 3.8472638234795897,
"density_atomic": 0.060683089195067416,
"volume": 148.3115002776022,
"volume_molar": 9.923919233316662,
"formula_full": "Rb2 Ni1 F6",
"formula_reduced": "Rb2NiF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 5.551115123125783e-17,
"spacegroup": 225
},
{
"id": "jvasp-52119",
"created_at": "2022-09-04T14:37:08.385582Z",
"updated_at": "2022-09-04T14:37:08.385596Z",
"structure_string": "Mn2 Re2 O8\n1.0\n0.000000 4.624848 -0.032560\n5.633897 0.000000 0.000000\n0.000000 -0.199697 -5.071016\nMn Re O\n2 2 8\ndirect\n0.500000 0.661926 0.750001 Mn\n0.500000 0.338074 0.250000 Mn\n-0.000001 0.167917 0.750001 Re\n-0.000000 0.832084 0.250000 Re\n0.266348 0.378722 0.901611 O\n0.733652 0.378722 0.598390 O\n0.733652 0.621278 0.098390 O\n0.266348 0.621278 0.401610 O\n0.221303 0.890870 0.933023 O\n0.778696 0.890870 0.566978 O\n0.221304 0.109130 0.433022 O\n0.778697 0.109130 0.066978 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Re",
"O"
],
"chemical_system": "Mn-O-Re",
"density": 7.667614373140846,
"density_atomic": 0.09079449330540591,
"volume": 132.166605739354,
"volume_molar": 6.632715862781781,
"formula_full": "Mn2 Re2 O8",
"formula_reduced": "MnReO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.570261540229885,
"spacegroup": 13
},
{
"id": "jvasp-12626",
"created_at": "2022-09-04T14:37:08.391576Z",
"updated_at": "2022-09-04T14:37:08.391595Z",
"structure_string": "In2 Fe2 O6\n1.0\n1.669719 -2.892038 0.000000\n1.669719 2.892038 -0.000000\n0.000000 0.000000 11.933947\nIn Fe O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.333333 0.666668 0.750000 Fe\n0.666668 0.333333 0.250000 Fe\n0.000000 0.000000 0.750000 O\n0.000000 0.000000 0.250000 O\n0.666668 0.333333 0.411349 O\n0.333333 0.666668 0.911349 O\n0.666668 0.333333 0.088651 O\n0.333333 0.666668 0.588651 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"In",
"Fe",
"O"
],
"chemical_system": "Fe-In-O",
"density": 6.30070774667838,
"density_atomic": 0.08676379017226689,
"volume": 115.25545368805697,
"volume_molar": 6.940845654671402,
"formula_full": "In2 Fe2 O6",
"formula_reduced": "InFeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.866133194,
"spacegroup": 194
},
{
"id": "jvasp-21234",
"created_at": "2022-09-04T14:37:08.394272Z",
"updated_at": "2022-09-04T14:37:08.394291Z",
"structure_string": "Tb4 Ti4 O14\n1.0\n6.230198 0.000000 3.597007\n2.076732 5.873887 3.597007\n0.000000 0.000000 7.194014\nTb Ti O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Tb\n-0.000000 0.500000 0.500000 Tb\n0.500000 -0.000000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 -0.000000 0.000000 Ti\n-0.000000 0.500000 0.000000 Ti\n0.079757 0.670243 0.079757 O\n0.670243 0.079757 0.670243 O\n0.670243 0.079757 0.079757 O\n0.625000 0.625000 0.625000 O\n0.920243 0.329757 0.329757 O\n0.329757 0.920243 0.329757 O\n0.329757 0.329757 0.920243 O\n0.920243 0.920243 0.329757 O\n0.920243 0.329757 0.920243 O\n0.079757 0.670243 0.670243 O\n0.329757 0.920243 0.920243 O\n0.375000 0.375000 0.375000 O\n0.670243 0.670243 0.079757 O\n0.079757 0.079757 0.670243 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tb",
"Ti",
"O"
],
"chemical_system": "O-Tb-Ti",
"density": 6.630093021857667,
"density_atomic": 0.08356491305832414,
"volume": 263.268388547776,
"volume_molar": 7.206542243150359,
"formula_full": "Tb4 Ti4 O14",
"formula_reduced": "Tb2Ti2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.687064360606061,
"spacegroup": 227
},
{
"id": "jvasp-13321",
"created_at": "2022-09-04T14:37:08.395154Z",
"updated_at": "2022-09-04T14:37:08.395177Z",
"structure_string": "Ca2 Sm4 S8\n1.0\n7.339086 0.016196 0.000000\n-2.431093 6.924754 0.000000\n-2.453997 -3.470476 5.982988\nCa Sm S\n2 4 8\ndirect\n0.625000 0.375000 0.250000 Ca\n0.875000 0.125000 0.750000 Ca\n0.121619 0.749999 0.871620 Sm\n0.250000 0.621619 0.371620 Sm\n0.378381 0.250000 0.628381 Sm\n0.750001 0.878380 0.128380 Sm\n0.003919 0.859099 0.501743 S\n0.002176 0.357356 0.498257 S\n0.496081 0.997824 0.855181 S\n0.140900 0.142643 0.144819 S\n0.359100 0.503919 0.001743 S\n0.642644 0.640900 0.644819 S\n0.497825 0.996081 0.355181 S\n0.857357 0.502175 0.998257 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Sm",
"S"
],
"chemical_system": "Ca-S-Sm",
"density": 5.119232350713859,
"density_atomic": 0.046007351898611284,
"volume": 304.29919180857235,
"volume_molar": 13.089518330181868,
"formula_full": "Ca2 Sm4 S8",
"formula_reduced": "Ca(SmS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.3372368814285711,
"spacegroup": 122
},
{
"id": "jvasp-12113",
"created_at": "2022-09-04T14:37:08.411364Z",
"updated_at": "2022-09-04T14:37:08.411389Z",
"structure_string": "Fe2 Cl2 O2\n1.0\n3.285324 0.000000 0.000000\n0.000000 3.741140 0.000000\n0.000000 0.000000 7.795224\nFe Cl O\n2 2 2\ndirect\n0.499999 0.000000 0.114770 Fe\n0.000000 0.500000 0.885230 Fe\n0.000000 0.000000 0.330859 Cl\n0.499999 0.500000 0.669140 Cl\n0.000000 0.000000 0.935111 O\n0.499999 0.500000 0.064889 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Cl",
"O"
],
"chemical_system": "Cl-Fe-O",
"density": 3.7192684430516336,
"density_atomic": 0.06262395387779174,
"volume": 95.8099836958358,
"volume_molar": 9.616353467160469,
"formula_full": "Fe2 Cl2 O2",
"formula_reduced": "FeClO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4195943558333337,
"spacegroup": 59
},
{
"id": "jvasp-32959",
"created_at": "2022-09-04T14:37:08.412345Z",
"updated_at": "2022-09-04T14:37:08.412369Z",
"structure_string": "S4 I8 N8\n1.0\n6.503482 -0.109371 0.051249\n2.963780 7.004213 2.135767\n-0.034549 0.149501 11.533528\nS I N\n4 8 8\ndirect\n0.759127 0.487393 0.375903 S\n0.240873 0.512606 0.624098 S\n0.756275 0.246232 0.115235 S\n0.243725 0.753767 0.884766 S\n0.724053 0.698595 0.688220 I\n0.275947 0.301405 0.311780 I\n0.633366 0.177141 0.794166 I\n0.149657 0.070633 0.620754 I\n0.876947 0.730926 0.054047 I\n0.366633 0.822859 0.205834 I\n0.123053 0.269074 0.945953 I\n0.850342 0.929366 0.379246 I\n0.006224 0.136814 0.106927 N\n-0.006224 0.863186 0.893074 N\n0.306312 0.388618 0.760320 N\n0.693687 0.611382 0.239680 N\n0.335430 0.834260 0.766431 N\n0.003201 0.350180 0.413378 N\n-0.003200 0.649819 0.586623 N\n0.664570 0.165740 0.233570 N\n",
"nsites": 20,
"nelements": 3,
"elements": [
"S",
"I",
"N"
],
"chemical_system": "I-N-S",
"density": 3.955561067550264,
"density_atomic": 0.037945056245013854,
"volume": 527.0778852153655,
"volume_molar": 15.870686081250271,
"formula_full": "S4 I8 N8",
"formula_reduced": "S(IN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.59175381,
"spacegroup": 2
},
{
"id": "jvasp-77052",
"created_at": "2022-09-04T14:37:08.707229Z",
"updated_at": "2022-09-04T14:37:08.707244Z",
"structure_string": "In1 Cu1 S2\n1.0\n-1.938397 3.357404 0.000000\n-3.876796 0.000000 -0.000000\n-1.938397 1.119135 6.169731\nIn Cu S\n1 1 2\ndirect\n0.004235 0.004238 0.987290 In\n0.863198 0.863202 0.410402 Cu\n0.739452 0.739457 0.781637 S\n0.240110 0.240111 0.279670 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Cu",
"S"
],
"chemical_system": "Cu-In-S",
"density": 5.014265358526267,
"density_atomic": 0.0498100766327783,
"volume": 80.30503605705633,
"volume_molar": 12.090205771811714,
"formula_full": "In1 Cu1 S2",
"formula_reduced": "InCuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.601877605,
"spacegroup": 160
},
{
"id": "jvasp-85176",
"created_at": "2022-09-04T14:37:08.425788Z",
"updated_at": "2022-09-04T14:37:08.425810Z",
"structure_string": "Eu2 Zn2 Ge2\n1.0\n4.342059 0.000000 0.000000\n0.000000 7.337907 0.000000\n0.000000 0.000000 4.020605\nEu Zn Ge\n2 2 2\ndirect\n0.250000 0.234074 0.000000 Eu\n0.750000 0.765927 0.000000 Eu\n0.250000 0.570188 0.499999 Zn\n0.750000 0.429813 0.499999 Zn\n0.250000 0.906557 0.499999 Ge\n0.750000 0.093443 0.499999 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Eu",
"Zn",
"Ge"
],
"chemical_system": "Eu-Ge-Zn",
"density": 7.518604268920859,
"density_atomic": 0.046837307198462255,
"volume": 128.10300930786622,
"volume_molar": 12.857572563859343,
"formula_full": "Eu2 Zn2 Ge2",
"formula_reduced": "EuZnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0312899999999999,
"spacegroup": 51
}
]
}