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=126",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=124",
"results": [
{
"id": "jvasp-111346",
"created_at": "2022-09-04T14:38:52.112405Z",
"updated_at": "2022-09-04T14:38:52.112435Z",
"structure_string": "Nd2 Tm1\n1.0\n3.502863 -0.011089 8.314387\n1.670962 3.078646 8.314387\n-0.018703 -0.011089 9.022125\nNd Tm\n2 1\ndirect\n0.775087 0.775089 0.775088 Nd\n0.224912 0.224912 0.224912 Nd\n0.000000 0.000000 0.000000 Tm\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nd",
"Tm"
],
"chemical_system": "Nd-Tm",
"density": 7.741787586183972,
"density_atomic": 0.03057735803355891,
"volume": 98.11181190695005,
"volume_molar": 19.69477138407657,
"formula_full": "Nd2 Tm1",
"formula_reduced": "Nd2Tm",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3741890833333334,
"spacegroup": 166
},
{
"id": "jvasp-118367",
"created_at": "2022-09-04T14:38:52.111660Z",
"updated_at": "2022-09-04T14:38:52.111686Z",
"structure_string": "Ca1 Al1 O1\n1.0\n3.655294 0.000000 0.000000\n0.000000 3.655294 -0.000000\n0.000000 0.000000 6.878589\nCa Al O\n1 1 1\ndirect\n0.000000 0.000000 -0.023753 Ca\n0.000000 0.000000 0.436731 Al\n0.000000 0.000000 0.681324 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Al",
"O"
],
"chemical_system": "Al-Ca-O",
"density": 1.5006917205191659,
"density_atomic": 0.032642038053166705,
"volume": 91.90602606104618,
"volume_molar": 18.44903418772828,
"formula_full": "Ca1 Al1 O1",
"formula_reduced": "CaAlO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7249422400000002,
"spacegroup": 99
},
{
"id": "jvasp-119169",
"created_at": "2022-09-04T14:38:52.111270Z",
"updated_at": "2022-09-04T14:38:52.111295Z",
"structure_string": "Mg2 Ag4 P4 S12\n1.0\n6.336286 -0.016425 0.470331\n-3.200546 5.468574 0.470331\n0.032399 0.056333 13.466802\nMg Ag P S\n2 4 4 12\ndirect\n0.418417 0.581582 0.250000 Mg\n0.581582 0.418416 0.750000 Mg\n0.042286 0.875694 0.364725 Ag\n0.957713 0.124304 0.635275 Ag\n0.124304 0.957713 0.135275 Ag\n0.875695 0.042285 0.864725 Ag\n0.219632 0.719988 0.835294 P\n0.780367 0.280010 0.164706 P\n0.280010 0.780366 0.664706 P\n0.719989 0.219632 0.335294 P\n0.870743 0.428885 0.878289 S\n0.129256 0.571113 0.121710 S\n0.262134 0.038909 0.882172 S\n0.737865 0.961089 0.117828 S\n0.961090 0.737864 0.617827 S\n0.480458 0.646256 0.880877 S\n0.646257 0.480457 0.380877 S\n0.353742 0.519541 0.619123 S\n0.519541 0.353742 0.119123 S\n0.428885 0.870743 0.378289 S\n0.038909 0.262134 0.382172 S\n0.571114 0.129255 0.621710 S\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Mg",
"Ag",
"P",
"S"
],
"chemical_system": "Ag-Mg-P-S",
"density": 3.5264572848650233,
"density_atomic": 0.04725222545493452,
"volume": 465.58653668030684,
"volume_molar": 12.744671181135049,
"formula_full": "Mg2 Ag4 P4 S12",
"formula_reduced": "MgAg2(PS3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 1.7045922336363637,
"spacegroup": 15
},
{
"id": "jvasp-122670",
"created_at": "2022-09-04T14:38:52.109996Z",
"updated_at": "2022-09-04T14:38:52.110022Z",
"structure_string": "Ho1 Ga3\n1.0\n5.420489 -0.833908 -0.891932\n-3.353450 4.339524 0.891932\n-0.826235 0.487178 4.031964\nHo Ga\n1 3\ndirect\n0.101042 0.898958 0.850999 Ho\n0.366283 0.633717 0.617608 Ga\n0.864591 0.135408 0.113937 Ga\n0.668084 0.331916 0.417454 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ho",
"Ga"
],
"chemical_system": "Ga-Ho",
"density": 7.756904204977358,
"density_atomic": 0.04994734446494329,
"volume": 80.08433767299668,
"volume_molar": 12.056978853453922,
"formula_full": "Ho1 Ga3",
"formula_reduced": "HoGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0161325,
"spacegroup": 107
},
{
"id": "jvasp-119959",
"created_at": "2022-09-04T14:38:52.109104Z",
"updated_at": "2022-09-04T14:38:52.109128Z",
"structure_string": "Ba2 Se1\n1.0\n4.609607 0.663223 -0.231379\n-3.972507 -5.258002 -0.248070\n-0.413118 0.618059 -6.451593\nBa Se\n2 1\ndirect\n0.019601 0.458100 0.962010 Ba\n0.019663 0.958130 0.462115 Ba\n0.019549 0.958065 -0.037874 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.15806748591656,
"density_atomic": 0.021243899589741044,
"volume": 141.21701090362615,
"volume_molar": 28.347623912269714,
"formula_full": "Ba2 Se1",
"formula_reduced": "Ba2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2865819899999999,
"spacegroup": 123
},
{
"id": "jvasp-111648",
"created_at": "2022-09-04T14:38:52.107379Z",
"updated_at": "2022-09-04T14:38:52.107396Z",
"structure_string": "Li8 Mn2 Co4 O14\n1.0\n2.839418 -0.003879 0.245291\n1.375358 6.140445 0.724476\n0.282582 -0.089544 13.247723\nLi Mn Co O\n8 2 4 14\ndirect\n0.139893 0.932223 0.787701 Li\n0.003621 0.504442 0.488885 Li\n0.863281 0.056602 0.217182 Li\n0.578126 0.207385 0.636662 Li\n0.435035 0.784976 0.345538 Li\n0.267552 0.380268 0.084105 Li\n0.712270 0.636064 0.938686 Li\n0.567439 0.713937 0.151216 Li\n0.002216 0.991673 0.003569 Mn\n0.858953 0.569776 0.712269 Mn\n0.286919 0.854957 0.571335 Co\n0.141265 0.433704 0.283903 Co\n0.714995 0.141476 0.428736 Co\n0.428362 0.287246 0.855864 Co\n0.869718 0.309710 0.950865 O\n0.559478 0.982407 0.898174 O\n0.422278 0.542094 0.613135 O\n0.272130 0.122564 0.333203 O\n-0.009321 0.263363 0.754984 O\n0.843866 0.835759 0.476450 O\n0.708459 0.390595 0.192394 O\n0.133887 0.701777 0.029988 O\n0.725393 0.876778 0.672717 O\n0.584127 0.446166 0.385926 O\n0.432106 0.042834 0.092846 O\n0.155996 0.159557 0.528847 O\n0.005466 0.735197 0.254162 O\n0.296502 0.596464 0.810661 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.4980829976093295,
"density_atomic": 0.12132969902835514,
"volume": 230.77614322158922,
"volume_molar": 4.963451494751179,
"formula_full": "Li8 Mn2 Co4 O14",
"formula_reduced": "Li4MnCo2O7",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 2.5575038243842365,
"spacegroup": 8
},
{
"id": "jvasp-119924",
"created_at": "2022-09-04T14:38:52.106149Z",
"updated_at": "2022-09-04T14:38:52.106174Z",
"structure_string": "B1 Se2\n1.0\n2.960075 0.000000 0.799286\n0.000000 3.828074 0.000000\n1.051325 0.000000 7.132824\nB Se\n1 2\ndirect\n0.333155 0.000000 0.097941 B\n0.004071 0.000000 -0.084140 Se\n0.062774 0.000000 0.386200 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"Se"
],
"chemical_system": "B-Se",
"density": 3.610250967566707,
"density_atomic": 0.038655800380119155,
"volume": 77.60801666243374,
"volume_molar": 15.578880014853379,
"formula_full": "B1 Se2",
"formula_reduced": "BSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.150283105555556,
"spacegroup": 6
},
{
"id": "jvasp-119211",
"created_at": "2022-09-04T14:38:52.105454Z",
"updated_at": "2022-09-04T14:38:52.105491Z",
"structure_string": "Al8 B1 C5\n1.0\n3.375639 0.009679 16.709397\n1.679184 2.928373 16.709397\n0.016652 0.009679 17.046953\nAl B C\n8 1 5\ndirect\n0.352987 0.352988 0.352988 Al\n0.854461 0.854462 0.854464 Al\n0.145537 0.145538 0.145538 Al\n0.647012 0.647012 0.647013 Al\n0.434534 0.434534 0.434535 Al\n0.935420 0.935421 0.935422 Al\n0.064579 0.064579 0.064579 Al\n0.565465 0.565466 0.565467 Al\n0.499999 0.500000 0.500001 B\n0.390959 0.390960 0.390961 C\n0.893131 0.893132 0.893134 C\n0.106867 0.106867 0.106868 C\n0.609039 0.609040 0.609041 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"B",
"C"
],
"chemical_system": "Al-B-C",
"density": 2.8484038726308474,
"density_atomic": 0.0837582030716852,
"volume": 167.14780745735408,
"volume_molar": 7.189911601668315,
"formula_full": "Al8 B1 C5",
"formula_reduced": "Al8BC5",
"formula_anonymous": "AB5C8",
"energy_above_hull": 4.2367653559523815,
"spacegroup": 166
},
{
"id": "jvasp-119167",
"created_at": "2022-09-04T14:38:52.101227Z",
"updated_at": "2022-09-04T14:38:52.101245Z",
"structure_string": "Mn2 Fe8 Si6\n1.0\n6.656002 -0.019870 0.000000\n-3.288259 5.787064 0.000000\n-0.000000 -0.000000 4.667486\nMn Fe Si\n2 8 6\ndirect\n0.001783 0.234954 -0.000000 Mn\n0.234954 0.001783 -0.000000 Mn\n0.332100 0.665879 0.250069 Fe\n0.665879 0.332100 0.250069 Fe\n0.665879 0.332100 0.749932 Fe\n0.332100 0.665879 0.749932 Fe\n0.765934 0.765934 -0.000000 Fe\n0.998537 0.761121 0.500000 Fe\n0.761121 0.998537 0.500000 Fe\n0.241486 0.241486 0.500000 Fe\n0.999015 0.602986 -0.000000 Si\n0.602986 0.999015 -0.000000 Si\n0.398639 0.398639 -0.000000 Si\n-0.000577 0.393544 0.500000 Si\n0.393545 -0.000577 0.500000 Si\n0.605321 0.605321 0.500000 Si\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mn",
"Fe",
"Si"
],
"chemical_system": "Fe-Mn-Si",
"density": 6.709017923473854,
"density_atomic": 0.08914613751604597,
"volume": 179.48057477106127,
"volume_molar": 6.755358030981473,
"formula_full": "Mn2 Fe8 Si6",
"formula_reduced": "MnFe4Si3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.949806880172413,
"spacegroup": 38
},
{
"id": "jvasp-123613",
"created_at": "2022-09-04T14:38:52.096510Z",
"updated_at": "2022-09-04T14:38:52.096534Z",
"structure_string": "P3 Ru1\n1.0\n2.995789 -0.000000 -0.959289\n-0.226217 3.577999 -0.706459\n0.223561 -0.800856 5.855621\nP Ru\n3 1\ndirect\n0.586527 0.125317 0.173054 P\n0.138476 0.573807 0.276951 P\n0.908799 0.423933 0.817600 P\n0.366196 0.876941 0.732394 Ru\n",
"nsites": 4,
"nelements": 2,
"elements": [
"P",
"Ru"
],
"chemical_system": "P-Ru",
"density": 5.2239063078799175,
"density_atomic": 0.06486703555122852,
"volume": 61.66460307625764,
"volume_molar": 9.283822990868813,
"formula_full": "P3 Ru1",
"formula_reduced": "P3Ru",
"formula_anonymous": "AB3",
"energy_above_hull": 3.3346567500000006,
"spacegroup": 8
},
{
"id": "jvasp-120437",
"created_at": "2022-09-04T14:38:52.096462Z",
"updated_at": "2022-09-04T14:38:52.096482Z",
"structure_string": "Pb2 Cl4 O14\n1.0\n5.903610 0.206619 3.916827\n1.185757 5.786992 3.916827\n0.092027 0.077803 8.587875\nPb Cl O\n2 4 14\ndirect\n0.377995 0.622005 0.250000 Pb\n0.622006 0.377994 0.750000 Pb\n0.805807 0.800133 0.179942 Cl\n0.800134 0.805806 0.679942 Cl\n0.194194 0.199866 0.820058 Cl\n0.199867 0.194193 0.320058 Cl\n0.422729 0.288155 0.151721 O\n0.288156 0.422728 0.651721 O\n0.577272 0.711844 0.848279 O\n0.711845 0.577271 0.348279 O\n0.275333 0.931792 0.404323 O\n0.931793 0.275332 0.904323 O\n0.121847 0.268233 0.485634 O\n0.068208 0.724667 0.095677 O\n0.726817 0.273183 0.250000 O\n0.268234 0.121846 0.985634 O\n0.878154 0.731766 0.514366 O\n0.731767 0.878153 0.014366 O\n0.724668 0.068207 0.595677 O\n0.273184 0.726816 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pb",
"Cl",
"O"
],
"chemical_system": "Cl-O-Pb",
"density": 4.500902414065172,
"density_atomic": 0.069482037493524,
"volume": 287.8441784592756,
"volume_molar": 8.66719079814159,
"formula_full": "Pb2 Cl4 O14",
"formula_reduced": "PbCl2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.0737603455,
"spacegroup": 15
},
{
"id": "jvasp-111338",
"created_at": "2022-09-04T14:38:52.095190Z",
"updated_at": "2022-09-04T14:38:52.095219Z",
"structure_string": "Tb2 Pr1\n1.0\n3.506578 -0.012128 8.222464\n1.670295 3.083237 8.222464\n-0.020443 -0.012128 8.938937\nTb Pr\n2 1\ndirect\n0.224165 0.224165 0.224164 Tb\n0.997921 0.997917 0.997915 Tb\n0.777921 0.777918 0.777916 Pr\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Tb",
"Pr"
],
"chemical_system": "Pr-Tb",
"density": 7.810883198244098,
"density_atomic": 0.030760140777383354,
"volume": 97.5288124235691,
"volume_molar": 19.577741219012324,
"formula_full": "Tb2 Pr1",
"formula_reduced": "Tb2Pr",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3487988833333335,
"spacegroup": 160
}
]
}