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=formula_reduced&page=1148",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=1146",
"results": [
{
"id": "jvasp-29563",
"created_at": "2022-09-04T14:37:11.835417Z",
"updated_at": "2022-09-04T14:37:11.835448Z",
"structure_string": "Cu1 B2 C8 N8\n1.0\n5.914412 -0.028383 -0.324272\n-0.162841 6.377727 -3.528320\n-0.059248 -0.011862 7.513343\nCu B C N\n1 2 8 8\ndirect\n0.500000 0.000000 0.000000 Cu\n0.134982 0.333755 0.667508 B\n0.865018 0.666246 0.332492 B\n0.131385 0.661586 0.323171 C\n0.240404 0.212164 0.778715 C\n0.198698 0.218699 0.437398 C\n0.759595 0.433450 0.221285 C\n0.868615 0.338415 0.676829 C\n0.801301 0.781302 0.562602 C\n0.240404 0.566552 0.778715 C\n0.759595 0.787837 0.221286 C\n0.318240 0.735323 0.857981 N\n0.672922 0.340444 0.680888 N\n0.757045 0.865879 0.731759 N\n0.318240 0.122660 0.857981 N\n0.681760 0.877341 0.142019 N\n0.242955 0.134122 0.268241 N\n0.681760 0.264679 0.142019 N\n0.327079 0.659557 0.319113 N\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Cu",
"B",
"C",
"N"
],
"chemical_system": "B-C-Cu-N",
"density": 1.7210438022198116,
"density_atomic": 0.06713881986491473,
"volume": 282.99573984512324,
"volume_molar": 8.969685156987751,
"formula_full": "Cu1 B2 C8 N8",
"formula_reduced": "CuB2(CN)8",
"formula_anonymous": "AB2C8D8",
"energy_above_hull": 6.522006927192982,
"spacegroup": 12
},
{
"id": "jvasp-88070",
"created_at": "2022-09-04T14:35:55.012633Z",
"updated_at": "2022-09-04T14:35:55.012658Z",
"structure_string": "Cu2 B8 O14\n1.0\n5.145428 0.000000 -0.000000\n-0.000000 5.583328 -2.997902\n0.000000 0.007508 6.337264\nCu B O\n2 8 14\ndirect\n0.750000 0.719763 0.719763 Cu\n0.250000 0.280237 0.280237 Cu\n0.750000 0.299880 0.072372 B\n0.500000 0.703293 0.296708 B\n0.750000 0.072372 0.299880 B\n0.250000 0.927629 0.700120 B\n0.000000 0.296708 0.703292 B\n0.500000 0.296708 0.703292 B\n0.250000 0.700120 0.927628 B\n0.000000 0.703293 0.296708 B\n0.479061 0.810748 0.556032 O\n0.020940 0.810748 0.556032 O\n0.979061 0.443969 0.189253 O\n0.250000 0.923685 0.923685 O\n0.250000 0.197882 0.756708 O\n0.979061 0.189253 0.443968 O\n0.250000 0.756709 0.197882 O\n0.479061 0.556032 0.810747 O\n0.020940 0.556032 0.810747 O\n0.750000 0.802118 0.243292 O\n0.750000 0.243292 0.802118 O\n0.750000 0.076315 0.076315 O\n0.520940 0.189253 0.443968 O\n0.520940 0.443969 0.189253 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cu",
"B",
"O"
],
"chemical_system": "B-Cu-O",
"density": 3.988463271585869,
"density_atomic": 0.1317402897951185,
"volume": 182.1766145901502,
"volume_molar": 4.571221734342309,
"formula_full": "Cu2 B8 O14",
"formula_reduced": "CuB4O7",
"formula_anonymous": "AB4C7",
"energy_above_hull": 3.3083471069444443,
"spacegroup": 63
},
{
"id": "jvasp-114482",
"created_at": "2022-09-04T14:38:40.828887Z",
"updated_at": "2022-09-04T14:38:40.828911Z",
"structure_string": "Cu1 B1 C1\n1.0\n3.327132 -0.000000 -0.000000\n-1.663566 2.881381 0.000000\n0.000000 0.000000 3.749578\nCu B C\n1 1 1\ndirect\n0.666665 0.333333 0.000000 Cu\n0.000000 0.000000 0.000000 B\n0.333332 0.666666 0.000000 C\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Cu",
"B",
"C"
],
"chemical_system": "B-C-Cu",
"density": 3.989765219072784,
"density_atomic": 0.08345803265657788,
"volume": 35.94621038270485,
"volume_molar": 7.215771290440736,
"formula_full": "Cu1 B1 C1",
"formula_reduced": "CuBC",
"formula_anonymous": "ABC",
"energy_above_hull": 3.523551011111111,
"spacegroup": 187
},
{
"id": "jvasp-11133",
"created_at": "2022-09-04T14:37:06.014879Z",
"updated_at": "2022-09-04T14:37:06.014898Z",
"structure_string": "Cu1 B1 C4 N4\n1.0\n5.409524 -0.000000 0.000000\n0.000000 5.409524 -0.000000\n0.000000 -0.000000 5.409524\nCu B C N\n1 1 4 4\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 B\n0.830918 0.169081 0.169081 C\n0.830918 0.830918 0.830918 C\n0.169081 0.169081 0.830918 C\n0.169081 0.830918 0.169081 C\n0.707055 0.707055 0.707055 N\n0.707055 0.292944 0.292944 N\n0.292944 0.292944 0.707055 N\n0.292944 0.707055 0.292944 N\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Cu",
"B",
"C",
"N"
],
"chemical_system": "B-C-Cu-N",
"density": 1.8716797494584112,
"density_atomic": 0.06317174072013525,
"volume": 158.29862983042065,
"volume_molar": 9.532966309539281,
"formula_full": "Cu1 B1 C4 N4",
"formula_reduced": "CuB(CN)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 5.864499603333333,
"spacegroup": 215
},
{
"id": "jvasp-56317",
"created_at": "2022-09-04T14:36:54.104117Z",
"updated_at": "2022-09-04T14:36:54.104133Z",
"structure_string": "Cu2 Bi2\n1.0\n2.217030 -3.840009 0.000000\n2.217030 3.840009 0.000000\n-0.000000 -0.000000 5.199798\nCu Bi\n2 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.666667 0.333333 0.250000 Bi\n0.333333 0.666667 0.750000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Bi"
],
"chemical_system": "Bi-Cu",
"density": 10.222741806769834,
"density_atomic": 0.04517932217559799,
"volume": 88.53607817428608,
"volume_molar": 13.329418127597865,
"formula_full": "Cu2 Bi2",
"formula_reduced": "CuBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.2103023749999999,
"spacegroup": 194
},
{
"id": "jvasp-99113",
"created_at": "2022-09-04T14:35:54.735780Z",
"updated_at": "2022-09-04T14:35:54.735799Z",
"structure_string": "Cu2 Bi4 Se8 O24\n1.0\n7.213546 0.000000 0.000000\n0.000000 7.680633 -2.921817\n0.000000 -0.013448 10.666387\nCu Bi Se O\n2 4 8 24\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.131006 0.260619 0.406866 Bi\n0.631006 0.239381 0.593134 Bi\n0.868995 0.739381 0.593134 Bi\n0.368994 0.760618 0.406866 Bi\n0.335451 0.884832 0.131041 Se\n0.829932 0.857813 0.307008 Se\n0.670068 0.357813 0.307008 Se\n0.164549 0.384832 0.131041 Se\n0.329932 0.642186 0.692992 Se\n0.835451 0.615167 0.868959 Se\n0.170068 0.142186 0.692992 Se\n0.664550 0.115167 0.868959 Se\n0.115654 0.935838 0.685946 O\n0.374505 0.323598 0.049500 O\n0.384346 0.435838 0.685946 O\n0.007700 0.197139 0.595474 O\n0.992301 0.802860 0.404526 O\n0.507700 0.302861 0.404526 O\n0.386934 0.684930 0.149511 O\n0.647114 0.918357 0.425249 O\n0.613066 0.315069 0.850488 O\n0.886935 0.815069 0.850488 O\n0.625495 0.676401 0.950500 O\n0.781461 0.520638 0.701651 O\n0.718539 0.020638 0.701651 O\n0.884346 0.064161 0.314054 O\n0.113066 0.184930 0.149512 O\n0.352887 0.081642 0.574750 O\n0.218539 0.479361 0.298349 O\n0.125495 0.823598 0.049499 O\n0.492300 0.697139 0.595474 O\n0.852887 0.418357 0.425250 O\n0.147114 0.581642 0.574750 O\n0.281461 0.979361 0.298349 O\n0.874506 0.176402 0.950500 O\n0.615654 0.564161 0.314053 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Cu",
"Bi",
"Se",
"O"
],
"chemical_system": "Bi-Cu-O-Se",
"density": 5.562495536145786,
"density_atomic": 0.0643322566927715,
"volume": 590.6834604213373,
"volume_molar": 9.360997219108373,
"formula_full": "Cu2 Bi4 Se8 O24",
"formula_reduced": "CuBi2(SeO3)4",
"formula_anonymous": "AB2C4D12",
"energy_above_hull": 2.327860237719298,
"spacegroup": 14
},
{
"id": "jvasp-111820",
"created_at": "2022-09-04T14:38:53.629042Z",
"updated_at": "2022-09-04T14:38:53.629069Z",
"structure_string": "Cu1 Bi12 Ir3\n1.0\n4.253626 0.000000 0.000000\n0.000000 9.063092 -0.032605\n0.000000 -0.096226 11.685286\nCu Bi Ir\n1 12 3\ndirect\n0.500000 0.596136 0.978462 Cu\n0.500000 0.797641 0.610776 Bi\n0.500000 0.284531 0.884242 Bi\n0.000000 0.215761 0.393752 Bi\n0.000000 0.691465 0.121795 Bi\n0.500000 0.892548 0.908408 Bi\n0.500000 0.400700 0.604952 Bi\n0.000000 0.106359 0.085852 Bi\n0.000000 0.612426 0.399295 Bi\n0.500000 0.918004 0.318331 Bi\n0.500000 0.388986 0.179341 Bi\n0.000000 0.090091 0.682964 Bi\n0.000000 0.584353 0.815333 Bi\n0.500000 0.108074 0.523213 Ir\n0.000000 0.408470 0.015640 Ir\n0.000000 0.904450 0.477642 Ir\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"Ir"
],
"chemical_system": "Bi-Cu-Ir",
"density": 11.60423140158262,
"density_atomic": 0.03551876134511796,
"volume": 450.4661591246395,
"volume_molar": 16.95481636165711,
"formula_full": "Cu1 Bi12 Ir3",
"formula_reduced": "Cu(Bi4Ir)3",
"formula_anonymous": "AB3C12",
"energy_above_hull": 1.894325959375,
"spacegroup": 6
},
{
"id": "jvasp-36830",
"created_at": "2022-09-04T14:38:00.002046Z",
"updated_at": "2022-09-04T14:38:00.002066Z",
"structure_string": "Cu2 Bi2 O4\n1.0\n-0.576185 3.710455 1.153891\n5.396665 0.000000 2.694772\n0.002032 0.021703 -6.755255\nCu Bi O\n2 2 4\ndirect\n-0.000000 0.278907 -0.000000 Cu\n-0.000000 0.721092 -0.000000 Cu\n0.304107 0.804106 0.608213 Bi\n0.695894 0.195892 0.391786 Bi\n0.159553 0.406960 0.319105 O\n0.159553 0.912144 0.319105 O\n0.840447 0.087854 0.680894 O\n0.840447 0.593038 0.680894 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-O",
"density": 7.466224489497987,
"density_atomic": 0.05905935513652616,
"volume": 135.45694803992666,
"volume_molar": 10.196760100205555,
"formula_full": "Cu2 Bi2 O4",
"formula_reduced": "CuBiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0728304375,
"spacegroup": 71
},
{
"id": "jvasp-36829",
"created_at": "2022-09-04T14:38:06.668263Z",
"updated_at": "2022-09-04T14:38:06.668282Z",
"structure_string": "Cu2 Bi2 O4\n1.0\n0.000000 6.140637 0.001774\n3.629771 0.000000 0.000000\n0.000000 -2.936026 -5.953124\nCu Bi O\n2 2 4\ndirect\n0.028908 0.250000 0.669371 Cu\n0.971092 0.750000 0.330629 Cu\n0.425183 0.250000 0.231064 Bi\n0.574816 0.750000 0.768936 Bi\n0.362918 0.250000 0.805264 O\n0.298417 0.750000 0.411939 O\n0.701583 0.250000 0.588061 O\n0.637081 0.750000 0.194736 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-O",
"density": 7.623012514297918,
"density_atomic": 0.060299580320062836,
"volume": 132.67090678802361,
"volume_molar": 9.987035942928971,
"formula_full": "Cu2 Bi2 O4",
"formula_reduced": "CuBiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0629479375,
"spacegroup": 11
},
{
"id": "jvasp-85958",
"created_at": "2022-09-04T14:36:20.024914Z",
"updated_at": "2022-09-04T14:36:20.024943Z",
"structure_string": "Cu2 Bi4 O8\n1.0\n4.997565 0.000000 2.421270\n2.498783 6.249322 1.210633\n-0.225998 -0.000000 6.834654\nCu Bi O\n2 4 8\ndirect\n0.680076 -0.000000 0.000000 Cu\n0.180032 -0.000000 0.000000 Cu\n0.656222 0.500054 0.164250 Bi\n0.820472 0.835750 0.500054 Bi\n0.156277 0.164250 0.499946 Bi\n0.320526 0.499946 0.835750 Bi\n0.763786 0.091567 0.704285 O\n0.355323 0.908497 0.704273 O\n0.559639 0.908433 0.295715 O\n0.468071 0.295715 0.091567 O\n0.059597 0.295727 0.908496 O\n0.968093 0.091503 0.295727 O\n0.855354 0.704285 0.908433 O\n0.263820 0.704273 0.091503 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-O",
"density": 8.353472435078501,
"density_atomic": 0.06455319297029521,
"volume": 216.8754070219615,
"volume_molar": 9.328958774775318,
"formula_full": "Cu2 Bi4 O8",
"formula_reduced": "Cu(BiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6405704357142854,
"spacegroup": 108
},
{
"id": "jvasp-86557",
"created_at": "2022-09-04T14:36:13.941360Z",
"updated_at": "2022-09-04T14:36:13.941388Z",
"structure_string": "Cu2 Bi4 O8\n1.0\n4.997491 0.000000 2.421234\n2.498746 6.249206 1.210616\n-0.225984 -0.000000 6.834533\nCu Bi O\n2 4 8\ndirect\n0.680039 -0.000000 -0.000000 Cu\n0.180039 -0.000000 -0.000000 Cu\n0.656289 0.500007 0.164237 Bi\n0.820527 0.835763 0.500006 Bi\n0.156296 0.164238 0.499993 Bi\n0.320533 0.499994 0.835762 Bi\n0.763771 0.091572 0.704284 O\n0.355342 0.908436 0.704273 O\n0.559628 0.908429 0.295715 O\n0.468055 0.295716 0.091572 O\n0.059616 0.295726 0.908435 O\n0.968050 0.091565 0.295726 O\n0.855344 0.704285 0.908427 O\n0.263777 0.704274 0.091565 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-O",
"density": 8.353904923551362,
"density_atomic": 0.0645565351147822,
"volume": 216.86417920521683,
"volume_molar": 9.328475806969147,
"formula_full": "Cu2 Bi4 O8",
"formula_reduced": "Cu(BiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6405704357142854,
"spacegroup": 108
},
{
"id": "jvasp-88449",
"created_at": "2022-09-04T14:36:01.829245Z",
"updated_at": "2022-09-04T14:36:01.829272Z",
"structure_string": "Cu4 Bi8 O16\n1.0\n5.997693 0.000000 0.000000\n-0.000000 8.429557 -0.000000\n-0.000000 -0.000000 8.429557\nCu Bi O\n4 8 16\ndirect\n0.424367 0.750000 0.750000 Cu\n0.575633 0.250000 0.250000 Cu\n0.924366 0.750000 0.750000 Cu\n0.075633 0.250000 0.250000 Cu\n0.750000 0.916744 0.416744 Bi\n0.750000 0.083256 0.916744 Bi\n0.250000 0.416744 0.916744 Bi\n0.750000 0.583257 0.083256 Bi\n0.250000 0.083256 0.583257 Bi\n0.250000 0.916744 0.083256 Bi\n0.250000 0.583257 0.416744 Bi\n0.750000 0.416744 0.583257 Bi\n0.091810 0.459570 0.151896 O\n0.408190 0.540430 0.651896 O\n0.408190 0.959570 0.848104 O\n0.091810 0.040430 0.348104 O\n0.091810 0.151896 0.040430 O\n0.091810 0.348104 0.459570 O\n0.591810 0.151896 0.459570 O\n0.908189 0.651896 0.540430 O\n0.591810 0.459570 0.348104 O\n0.591810 0.040430 0.151896 O\n0.908189 0.959570 0.651896 O\n0.908189 0.848104 0.959570 O\n0.408190 0.651896 0.959570 O\n0.908189 0.540430 0.848104 O\n0.591810 0.348104 0.040430 O\n0.408190 0.848104 0.540430 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-O",
"density": 8.501853386499468,
"density_atomic": 0.06569983758600868,
"volume": 426.1806578036782,
"volume_molar": 9.166142537439795,
"formula_full": "Cu4 Bi8 O16",
"formula_reduced": "Cu(BiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.626599007142857,
"spacegroup": 130
}
]
}