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=-created_at&page=1289",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=1287",
"results": [
{
"id": "jvasp-9591",
"created_at": "2022-09-04T14:38:05.661329Z",
"updated_at": "2022-09-04T14:38:05.661354Z",
"structure_string": "Ho4 Cd2 Se8\n1.0\n7.164712 0.000000 4.136548\n2.388237 6.754955 4.136548\n0.000000 0.000000 8.273096\nHo Cd Se\n4 2 8\ndirect\n0.500000 0.500000 0.000000 Ho\n0.500000 0.500000 0.500000 Ho\n0.000000 0.500000 0.500000 Ho\n0.500000 -0.000000 0.500000 Ho\n0.125000 0.125000 0.125000 Cd\n0.875000 0.875001 0.875001 Cd\n0.742938 0.742939 0.742939 Se\n0.257062 0.257062 0.728814 Se\n0.257062 0.728814 0.257062 Se\n0.728813 0.257062 0.257062 Se\n0.742938 0.271187 0.742939 Se\n0.271186 0.742939 0.742938 Se\n0.257062 0.257062 0.257062 Se\n0.742938 0.742939 0.271187 Se\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ho",
"Cd",
"Se"
],
"chemical_system": "Cd-Ho-Se",
"density": 6.288151493770177,
"density_atomic": 0.03496542197946239,
"volume": 400.3955681765593,
"volume_molar": 17.223131937424405,
"formula_full": "Ho4 Cd2 Se8",
"formula_reduced": "Ho2CdSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.8325134785714285,
"spacegroup": 227
},
{
"id": "jvasp-18332",
"created_at": "2022-09-04T14:38:05.661073Z",
"updated_at": "2022-09-04T14:38:05.661105Z",
"structure_string": "U2 N2 Cl2\n1.0\n3.878508 0.000000 0.000000\n0.000000 3.878508 -0.000000\n0.000000 0.000000 7.076914\nU N Cl\n2 2 2\ndirect\n0.500000 0.000000 0.836302 U\n0.000000 0.500000 0.163697 U\n0.500000 0.500000 0.000000 N\n0.000000 0.000000 0.000000 N\n0.000000 0.500000 0.626957 Cl\n0.500000 0.000000 0.373042 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"N",
"Cl"
],
"chemical_system": "Cl-N-U",
"density": 8.96863676174126,
"density_atomic": 0.0563609038526931,
"volume": 106.45677393112462,
"volume_molar": 10.684961291145518,
"formula_full": "U2 N2 Cl2",
"formula_reduced": "UNCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.730684439166666,
"spacegroup": 129
},
{
"id": "jvasp-46018",
"created_at": "2022-09-04T14:38:05.660784Z",
"updated_at": "2022-09-04T14:38:05.660809Z",
"structure_string": "Al4 Tl4 O12\n1.0\n5.243809 -0.000000 0.000000\n-0.000000 5.353023 0.000000\n0.000000 0.000000 7.590355\nAl Tl O\n4 4 12\ndirect\n0.000000 0.500000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.012297 0.961902 0.750000 Tl\n0.487703 0.461902 0.750000 Tl\n0.512297 0.538097 0.250000 Tl\n0.987703 0.038097 0.250000 Tl\n0.793439 0.790434 0.050688 O\n0.706561 0.290434 0.449313 O\n0.706561 0.290434 0.050688 O\n0.595616 0.033663 0.750000 O\n0.404384 0.966337 0.250000 O\n0.206561 0.209565 0.550688 O\n0.293439 0.709565 0.949313 O\n0.206561 0.209565 0.949313 O\n0.793439 0.790434 0.449313 O\n0.095616 0.466337 0.250000 O\n0.293439 0.709565 0.550688 O\n0.904384 0.533662 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Al",
"Tl",
"O"
],
"chemical_system": "Al-O-Tl",
"density": 8.70903372543686,
"density_atomic": 0.09386894425820536,
"volume": 213.06301203288265,
"volume_molar": 6.415477246057966,
"formula_full": "Al4 Tl4 O12",
"formula_reduced": "AlTlO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.3636131799999998,
"spacegroup": 62
},
{
"id": "jvasp-29780",
"created_at": "2022-09-04T14:38:05.660127Z",
"updated_at": "2022-09-04T14:38:05.660149Z",
"structure_string": "Cd1 In1 Ga1 S4\n1.0\n4.028362 -0.000000 0.000000\n-2.014181 3.488663 -0.000000\n0.000000 0.000000 12.608231\nCd In Ga S\n1 1 1 4\ndirect\n0.000000 0.000000 0.543468 Cd\n0.333333 0.666666 0.830229 In\n0.333333 0.666666 0.261077 Ga\n0.000000 0.000000 0.343172 S\n0.666667 0.333333 0.905393 S\n0.333333 0.666666 0.626809 S\n0.333333 0.666666 0.094852 S\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Cd",
"In",
"Ga",
"S"
],
"chemical_system": "Cd-Ga-In-S",
"density": 3.984858852920524,
"density_atomic": 0.03950539178226099,
"volume": 177.19100315676891,
"volume_molar": 15.24384517736667,
"formula_full": "Cd1 In1 Ga1 S4",
"formula_reduced": "CdInGaS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 0.7175374349999999,
"spacegroup": 156
},
{
"id": "jvasp-14120",
"created_at": "2022-09-04T14:38:05.651130Z",
"updated_at": "2022-09-04T14:38:05.651154Z",
"structure_string": "Zn4 P6 S18\n1.0\n6.520436 0.019082 0.550504\n0.471318 9.225232 5.163410\n0.040773 0.011981 10.582346\nZn P S\n4 6 18\ndirect\n0.323000 0.951646 0.300550 Zn\n0.677001 0.048354 0.699450 Zn\n0.322999 0.300550 0.951646 Zn\n0.677001 0.699450 0.048354 Zn\n0.289967 0.623857 0.623857 P\n0.375461 0.281382 0.281382 P\n0.624540 0.718618 0.718618 P\n0.651842 0.024247 0.024247 P\n0.348158 0.975752 0.975753 P\n0.710034 0.376143 0.376143 P\n0.705814 0.258685 0.258685 S\n0.294186 0.741315 0.741315 S\n0.327293 0.757462 0.081190 S\n0.844473 0.566745 0.267078 S\n0.155528 0.732921 0.433255 S\n0.155527 0.433255 0.732922 S\n0.844473 0.267078 0.566745 S\n0.755785 0.907786 0.584232 S\n0.755785 0.584232 0.907786 S\n0.244215 0.092214 0.415768 S\n0.327293 0.081190 0.757463 S\n0.846934 0.926616 0.926617 S\n0.672707 0.918809 0.242538 S\n0.380572 0.397825 0.397825 S\n0.619429 0.602175 0.602175 S\n0.153066 0.073384 0.073384 S\n0.244215 0.415768 0.092214 S\n0.672707 0.242537 0.918810 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Zn",
"P",
"S"
],
"chemical_system": "P-S-Zn",
"density": 2.6758696664350365,
"density_atomic": 0.044035096374792575,
"volume": 635.8564487218496,
"volume_molar": 13.675775133416785,
"formula_full": "Zn4 P6 S18",
"formula_reduced": "Zn2(PS3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 1.98702195,
"spacegroup": 12
},
{
"id": "jvasp-44434",
"created_at": "2022-09-04T14:38:05.645123Z",
"updated_at": "2022-09-04T14:38:05.645145Z",
"structure_string": "Na2 V2 Si2 C2 O14\n1.0\n0.000000 5.385802 -0.202287\n6.401461 0.000000 0.000000\n0.000000 -0.174690 -8.485385\nNa V Si C O\n2 2 2 2 14\ndirect\n0.851357 0.518100 0.164283 Na\n0.148642 0.018100 0.835718 Na\n0.228023 0.234099 0.337711 V\n0.771976 0.734099 0.662289 V\n0.276453 0.738682 0.433795 Si\n0.723547 0.238682 0.566206 Si\n0.380975 0.258216 0.063095 C\n0.619024 0.758216 0.936906 C\n0.475651 0.769874 0.813742 O\n0.768518 0.454548 0.666737 O\n0.786409 0.038039 0.672142 O\n0.086450 0.749323 0.588179 O\n0.435662 0.244302 0.501805 O\n0.564338 0.744302 0.498196 O\n0.524348 0.269874 0.186259 O\n0.213590 0.538039 0.327859 O\n0.231482 0.954548 0.333264 O\n0.857366 0.739076 0.888298 O\n0.142634 0.239076 0.111703 O\n0.554117 0.757889 0.076907 O\n0.913550 0.249323 0.411822 O\n0.445882 0.257889 0.923094 O\n",
"nsites": 22,
"nelements": 5,
"elements": [
"Na",
"V",
"Si",
"C",
"O"
],
"chemical_system": "C-Na-O-Si-V",
"density": 2.563867176734446,
"density_atomic": 0.07514255497247885,
"volume": 292.77684273654995,
"volume_molar": 8.014287991944943,
"formula_full": "Na2 V2 Si2 C2 O14",
"formula_reduced": "NaVSiCO7",
"formula_anonymous": "ABCDE7",
"energy_above_hull": 3.069495118181817,
"spacegroup": 4
},
{
"id": "jvasp-45869",
"created_at": "2022-09-04T14:38:05.642939Z",
"updated_at": "2022-09-04T14:38:05.642957Z",
"structure_string": "Mg3 Fe3 O8\n1.0\n0.001852 4.162762 4.162762\n4.162762 0.001852 4.162762\n4.162762 4.162762 0.001852\nMg Fe O\n3 3 8\ndirect\n0.625000 0.125000 0.625000 Mg\n0.625000 0.625000 0.125000 Mg\n0.125000 0.625000 0.625000 Mg\n0.993782 0.993782 0.993782 Fe\n0.256217 0.256217 0.256217 Fe\n0.625000 0.625000 0.625000 Fe\n0.855203 0.393160 0.393160 O\n0.382777 0.382777 0.382777 O\n0.393160 0.855203 0.393160 O\n0.393160 0.393160 0.855203 O\n0.856839 0.394796 0.856839 O\n0.856839 0.856839 0.394796 O\n0.394796 0.856839 0.856839 O\n0.867222 0.867222 0.867222 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Fe",
"O"
],
"chemical_system": "Fe-Mg-O",
"density": 4.243626782682752,
"density_atomic": 0.09710536317985459,
"volume": 144.17329323067122,
"volume_molar": 6.2016561833418375,
"formula_full": "Mg3 Fe3 O8",
"formula_reduced": "Mg3Fe3O8",
"formula_anonymous": "A3B3C8",
"energy_above_hull": 2.237147260714285,
"spacegroup": 166
},
{
"id": "jvasp-37857",
"created_at": "2022-09-04T14:38:05.642789Z",
"updated_at": "2022-09-04T14:38:05.642820Z",
"structure_string": "Cu2 Ag6\n1.0\n2.841753 -4.922061 -0.000000\n2.841753 4.922061 0.000000\n-0.000000 0.000000 4.654428\nCu Ag\n2 6\ndirect\n0.666667 0.333333 0.250000 Cu\n0.333333 0.666667 0.750000 Cu\n0.830899 0.661800 0.750000 Ag\n0.830900 0.169100 0.750000 Ag\n0.338199 0.169100 0.750000 Ag\n0.169100 0.338199 0.250000 Ag\n0.169100 0.830900 0.250000 Ag\n0.661800 0.830899 0.250000 Ag\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"Ag"
],
"chemical_system": "Ag-Cu",
"density": 9.874824792842562,
"density_atomic": 0.06144129432152394,
"volume": 130.20559036624107,
"volume_molar": 9.801454911555046,
"formula_full": "Cu2 Ag6",
"formula_reduced": "CuAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-37160",
"created_at": "2022-09-04T14:38:05.640133Z",
"updated_at": "2022-09-04T14:38:05.640160Z",
"structure_string": "Na1 Sc1 S2\n1.0\n-1.878350 -3.253397 -0.000000\n-3.756700 -0.000000 -0.000000\n-1.878350 -1.084466 -6.560515\nNa Sc S\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.739400 0.739398 0.781804 S\n0.260602 0.260602 0.218196 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sc",
"S"
],
"chemical_system": "Na-S-Sc",
"density": 2.7352085635824817,
"density_atomic": 0.04988597696081003,
"volume": 80.1828538537466,
"volume_molar": 12.07181081114426,
"formula_full": "Na1 Sc1 S2",
"formula_reduced": "NaScS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9411285625,
"spacegroup": 166
},
{
"id": "jvasp-40503",
"created_at": "2022-09-04T14:38:05.639660Z",
"updated_at": "2022-09-04T14:38:05.639693Z",
"structure_string": "Sc1 Zn1 Pt2\n1.0\n-0.000002 3.190031 3.190031\n3.190031 -0.000002 3.190031\n3.190031 3.190031 -0.000002\nSc Zn Pt\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.750000 Zn\n-0.000002 -0.000002 -0.000002 Pt\n0.500003 0.500003 0.500003 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Zn",
"Pt"
],
"chemical_system": "Pt-Sc-Zn",
"density": 12.801669838632133,
"density_atomic": 0.061609101747084345,
"volume": 64.92547183078027,
"volume_molar": 9.774758256859341,
"formula_full": "Sc1 Zn1 Pt2",
"formula_reduced": "ScZnPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3258196125,
"spacegroup": 225
},
{
"id": "jvasp-4276",
"created_at": "2022-09-04T14:38:05.635168Z",
"updated_at": "2022-09-04T14:38:05.635197Z",
"structure_string": "V2 Cl6\n1.0\n5.361505 -0.010774 4.026632\n2.005666 4.972238 4.026632\n-0.015997 -0.010773 6.705165\nV Cl\n2 6\ndirect\n0.666642 0.666643 0.666641 V\n0.333358 0.333359 0.333358 V\n0.570876 0.270805 0.921337 Cl\n0.270805 0.921338 0.570875 Cl\n0.078662 0.429125 0.729196 Cl\n0.729196 0.078663 0.429123 Cl\n0.429125 0.729196 0.078661 Cl\n0.921338 0.570877 0.270803 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"V",
"Cl"
],
"chemical_system": "Cl-V",
"density": 2.912581434196631,
"density_atomic": 0.044602465669864325,
"volume": 179.36228143111836,
"volume_molar": 13.501811322661613,
"formula_full": "V2 Cl6",
"formula_reduced": "VCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.8383891006250002,
"spacegroup": 148
},
{
"id": "jvasp-40664",
"created_at": "2022-09-04T14:38:05.630810Z",
"updated_at": "2022-09-04T14:38:05.630830Z",
"structure_string": "Li12 V2 O6 F6\n1.0\n5.158023 -0.031206 0.047164\n-1.837336 -6.225697 -0.010762\n-0.272015 0.049941 -7.750969\nLi V O F\n12 2 6 6\ndirect\n0.885588 0.082336 0.342179 Li\n0.760742 0.663339 0.219762 Li\n0.710488 0.172462 0.757913 Li\n0.076471 0.451825 0.142277 Li\n0.397047 0.802029 0.908887 Li\n0.444314 0.322071 0.410466 Li\n0.554537 0.677684 0.600360 Li\n0.612652 0.196898 0.099919 Li\n0.933210 0.546899 0.853283 Li\n0.280334 0.350679 0.763514 Li\n0.326470 0.833199 0.231801 Li\n0.093119 0.912451 0.655109 Li\n0.980039 0.994024 0.011068 V\n0.962489 0.493330 0.511666 V\n0.783218 0.367567 0.294836 O\n0.968863 0.277347 0.941591 O\n0.649768 0.415088 0.643335 O\n0.663721 0.918493 0.136252 O\n0.069377 0.726505 0.051638 O\n0.215437 0.649737 0.691938 O\n0.882352 0.788180 0.449428 F\n0.232445 0.115277 0.233349 F\n0.352885 0.081912 0.858148 F\n0.330499 0.574959 0.351988 F\n0.762350 0.881042 0.778599 F\n0.071559 0.204687 0.560705 F\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 2.632474010116005,
"density_atomic": 0.10430697882499461,
"volume": 249.26424188378215,
"volume_molar": 5.7734782733031675,
"formula_full": "Li12 V2 O6 F6",
"formula_reduced": "Li6V(OF)3",
"formula_anonymous": "AB3C3D6",
"energy_above_hull": 1.2518342728846157,
"spacegroup": 1
}
]
}