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=nsites&page=4051",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=4049",
"results": [
{
"id": "jvasp-42560",
"created_at": "2022-09-04T14:36:05.905815Z",
"updated_at": "2022-09-04T14:36:05.905841Z",
"structure_string": "Sr4 Ta4 N4 O8\n1.0\n3.997777 4.114729 0.000190\n-3.997777 4.114729 -0.000190\n0.000439 0.000000 8.072289\nSr Ta N O\n4 4 4 8\ndirect\n-0.003479 -0.003479 0.250000 Sr\n0.506257 0.506257 0.250000 Sr\n0.507750 0.507749 0.750000 Sr\n0.995601 0.995601 0.750000 Sr\n-0.001331 0.491746 0.508931 Ta\n0.015203 0.510468 0.997780 Ta\n0.491747 -0.001331 0.991069 Ta\n0.510468 0.015202 0.502220 Ta\n0.748836 0.249471 0.495277 N\n0.459614 0.036523 0.750058 N\n0.036523 0.459614 0.749943 N\n0.249471 0.748836 0.004723 N\n0.247422 0.746789 0.490394 O\n0.540975 0.953812 0.250756 O\n0.248326 0.248200 0.049030 O\n0.748961 0.748855 0.534675 O\n0.248200 0.248326 0.450970 O\n0.748855 0.748961 0.965325 O\n0.953812 0.540975 0.249244 O\n0.746789 0.247422 0.009606 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ta",
"N",
"O"
],
"chemical_system": "N-O-Sr-Ta",
"density": 7.8676414294823855,
"density_atomic": 0.07530841318156684,
"volume": 265.5745773288366,
"volume_molar": 7.996637434758794,
"formula_full": "Sr4 Ta4 N4 O8",
"formula_reduced": "SrTaNO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.9038811520000003,
"spacegroup": 21
},
{
"id": "jvasp-52553",
"created_at": "2022-09-04T14:36:05.923119Z",
"updated_at": "2022-09-04T14:36:05.923144Z",
"structure_string": "K8 Sn4 O8\n1.0\n7.221689 -0.015557 0.005855\n-3.574663 -6.529103 -0.021460\n-3.321774 0.951235 -9.242394\nK Sn O\n8 4 8\ndirect\n0.390477 0.428234 0.135743 K\n0.935657 0.453833 0.174213 K\n0.930676 0.935780 0.185475 K\n0.241517 0.742755 0.509443 K\n0.758483 0.257244 0.490556 K\n0.069325 0.064219 0.814524 K\n0.064344 0.546166 0.825786 K\n0.609523 0.571765 0.864256 K\n0.602063 0.055515 0.872064 Sn\n0.303319 0.291370 0.525890 Sn\n0.696682 0.708629 0.474109 Sn\n0.397937 0.944484 0.127935 Sn\n0.064416 0.784878 0.018088 O\n0.504766 0.807635 0.009284 O\n0.340777 0.517485 0.374102 O\n0.803362 0.599323 0.350152 O\n0.196638 0.400676 0.649847 O\n0.659224 0.482514 0.625897 O\n0.495234 0.192364 0.990715 O\n0.935584 0.215121 0.981911 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Sn",
"O"
],
"chemical_system": "K-O-Sn",
"density": 3.484793216171308,
"density_atomic": 0.04583971211367012,
"volume": 436.3029146083072,
"volume_molar": 13.13738782884743,
"formula_full": "K8 Sn4 O8",
"formula_reduced": "K2SnO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.4008769399999996,
"spacegroup": 2
},
{
"id": "jvasp-97686",
"created_at": "2022-09-04T14:36:05.991139Z",
"updated_at": "2022-09-04T14:36:05.991153Z",
"structure_string": "Yb4 Cr4 Sb12\n1.0\n6.066378 0.000000 0.000000\n0.000000 6.186100 0.000000\n0.000000 0.000000 13.058506\nYb Cr Sb\n4 4 12\ndirect\n0.750000 0.995715 0.691039 Yb\n0.750000 0.495715 0.308962 Yb\n0.250000 0.504285 0.691039 Yb\n0.250000 0.004285 0.308962 Yb\n0.500000 0.750000 0.095881 Cr\n0.000000 0.750000 0.095881 Cr\n0.500000 0.250000 0.904119 Cr\n0.000000 0.250000 0.904119 Cr\n0.500000 0.250000 0.502878 Sb\n0.000000 0.250000 0.502878 Sb\n0.500000 0.750000 0.497122 Sb\n0.750000 0.892949 0.935348 Sb\n0.750000 0.392949 0.064652 Sb\n0.250000 0.607051 0.935348 Sb\n0.750000 0.499979 0.781957 Sb\n0.250000 0.500021 0.218043 Sb\n0.750000 -0.000021 0.218043 Sb\n0.250000 0.000021 0.781957 Sb\n0.000000 0.750000 0.497122 Sb\n0.250000 0.107051 0.064652 Sb\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Yb",
"Cr",
"Sb"
],
"chemical_system": "Cr-Sb-Yb",
"density": 8.001175929717428,
"density_atomic": 0.040812208671704577,
"volume": 490.049439884055,
"volume_molar": 14.755733531704687,
"formula_full": "Yb4 Cr4 Sb12",
"formula_reduced": "YbCrSb3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.81277328,
"spacegroup": 57
},
{
"id": "jvasp-43550",
"created_at": "2022-09-04T14:36:05.993955Z",
"updated_at": "2022-09-04T14:36:05.993971Z",
"structure_string": "Li4 Ti2 Ni4 O10\n1.0\n-2.852803 3.330538 2.344166\n-1.426534 5.921940 -4.875823\n-2.982429 -3.342934 -2.353019\nLi Ti Ni O\n4 2 4 10\ndirect\n0.903734 0.192534 0.499997 Li\n0.099457 0.801078 0.499997 Li\n0.600545 0.798918 0.000001 Li\n0.796274 0.407456 0.000001 Li\n0.702535 0.594929 0.499997 Ti\n0.997465 0.005068 0.000000 Ti\n0.198455 0.603102 -0.000003 Ni\n0.399732 0.200526 0.000000 Ni\n0.300267 0.399482 0.499998 Ni\n0.501546 0.996904 0.500001 Ni\n0.547370 0.410650 0.254200 O\n0.849998 0.800000 0.749997 O\n0.658009 0.189352 0.754193 O\n0.459146 0.597695 0.735792 O\n0.943159 0.597696 0.264199 O\n0.041993 0.410650 0.745806 O\n0.240854 0.002305 0.764208 O\n0.350000 0.800000 0.250001 O\n0.756839 0.002303 0.235797 O\n0.152627 0.189350 0.245797 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Ti",
"density": 4.887410348666169,
"density_atomic": 0.11358142651844788,
"volume": 176.0851277629587,
"volume_molar": 5.302047125655607,
"formula_full": "Li4 Ti2 Ni4 O10",
"formula_reduced": "Li2TiNi2O5",
"formula_anonymous": "AB2C2D5",
"energy_above_hull": 2.121559063333333,
"spacegroup": 15
},
{
"id": "jvasp-98510",
"created_at": "2022-09-04T14:36:06.030818Z",
"updated_at": "2022-09-04T14:36:06.030838Z",
"structure_string": "K4 N4 O12\n1.0\n5.430182 -0.000000 0.000000\n0.000000 6.121955 0.000000\n0.000000 0.000000 9.113376\nK N O\n4 4 12\ndirect\n0.750000 0.742046 0.582850 K\n0.750000 0.242046 0.917151 K\n0.250000 0.757953 0.082849 K\n0.250000 0.257954 0.417151 K\n0.250000 0.901753 0.742890 N\n0.750000 0.598246 0.242890 N\n0.250000 0.401754 0.757111 N\n0.750000 0.098246 0.257111 N\n0.952989 0.597461 0.312911 O\n0.047010 0.902537 0.812911 O\n0.547010 0.097462 0.187089 O\n0.750000 0.604479 0.103362 O\n0.750000 0.104480 0.396638 O\n0.250000 0.895520 0.603362 O\n0.547010 0.597461 0.312911 O\n0.047010 0.402538 0.687089 O\n0.952989 0.097462 0.187089 O\n0.452990 0.902537 0.812911 O\n0.452990 0.402538 0.687089 O\n0.250000 0.395520 0.896638 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"N",
"O"
],
"chemical_system": "K-N-O",
"density": 2.2166145663135937,
"density_atomic": 0.06601554121738908,
"volume": 302.9589643768886,
"volume_molar": 9.122307639907245,
"formula_full": "K4 N4 O12",
"formula_reduced": "KNO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.22743435,
"spacegroup": 62
},
{
"id": "jvasp-87167",
"created_at": "2022-09-04T14:36:06.094232Z",
"updated_at": "2022-09-04T14:36:06.094258Z",
"structure_string": "Er4 Ni4 O12\n1.0\n5.139714 0.000000 -0.005102\n0.000000 5.565810 0.000000\n0.007066 0.000000 7.320035\nEr Ni O\n4 4 12\ndirect\n0.977519 0.080507 0.249998 Er\n0.022481 0.919493 0.750003 Er\n0.477520 0.419493 0.749999 Er\n0.522481 0.580507 0.250002 Er\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.607794 0.032727 0.749997 O\n0.892206 0.532727 0.750004 O\n0.690147 0.305256 0.447898 O\n0.690148 0.305255 0.052101 O\n0.809851 0.805255 0.447900 O\n0.309852 0.694745 0.947900 O\n0.190149 0.194745 0.552101 O\n0.190148 0.194744 0.947898 O\n0.309853 0.694744 0.552103 O\n0.809852 0.805256 0.052103 O\n0.107794 0.467273 0.249997 O\n0.392206 0.967273 0.250004 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Er",
"Ni",
"O"
],
"chemical_system": "Er-Ni-O",
"density": 8.689613115788287,
"density_atomic": 0.09551005427858782,
"volume": 209.4020378384787,
"volume_molar": 6.305242736470825,
"formula_full": "Er4 Ni4 O12",
"formula_reduced": "ErNiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.56069458,
"spacegroup": 62
},
{
"id": "jvasp-48323",
"created_at": "2022-09-04T14:35:58.472154Z",
"updated_at": "2022-09-04T14:35:58.472178Z",
"structure_string": "Li10 Mn2 O6 F2\n1.0\n-1.850615 -4.577430 -4.255016\n-1.850615 4.577430 -4.255016\n3.757380 0.000000 -2.859945\nLi Mn O F\n10 2 6 2\ndirect\n0.961501 0.545720 0.243199 Li\n0.456979 0.052953 0.753343 Li\n0.197048 0.793021 0.496659 Li\n0.793021 0.197048 0.496659 Li\n0.769498 0.769498 0.727542 Li\n0.052953 0.456979 0.753343 Li\n0.545720 0.961501 0.243199 Li\n0.288499 0.704280 0.006804 Li\n0.704280 0.288499 0.006804 Li\n0.480502 0.480502 0.522461 Li\n0.256461 0.256461 0.248740 Mn\n-0.006461 -0.006461 0.001261 Mn\n0.981133 0.268867 0.125002 O\n0.268867 0.981133 0.125002 O\n0.223536 0.518411 0.373995 O\n0.518411 0.223536 0.373995 O\n0.731589 0.026464 0.876007 O\n0.026464 0.731589 0.876007 O\n0.772998 0.477002 0.625002 F\n0.477002 0.772998 0.625002 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O",
"density": 2.670237728436593,
"density_atomic": 0.10265949683654176,
"volume": 194.81880017242574,
"volume_molar": 5.8661311866633,
"formula_full": "Li10 Mn2 O6 F2",
"formula_reduced": "Li5MnO3F",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 1.5570368023879309,
"spacegroup": 12
},
{
"id": "jvasp-97511",
"created_at": "2022-09-04T14:36:06.288554Z",
"updated_at": "2022-09-04T14:36:06.288581Z",
"structure_string": "K4 Cu4 Cl12\n1.0\n3.907584 0.702752 0.000000\n0.466859 10.402268 0.000000\n0.000000 0.000000 12.299793\nK Cu Cl\n4 4 12\ndirect\n0.509399 0.491220 0.167366 K\n0.490600 0.008780 0.667365 K\n0.490600 0.508780 0.832634 K\n0.509399 -0.008781 0.332634 K\n0.776659 0.362596 0.551703 Cu\n0.776659 0.862596 0.948297 Cu\n0.223340 0.137404 0.051703 Cu\n0.223340 0.637404 0.448297 Cu\n0.633766 0.586668 0.587360 Cl\n-0.113668 0.178096 0.202845 Cl\n0.895703 0.649860 -0.002757 Cl\n0.366233 0.913333 0.087360 Cl\n0.113668 0.821904 0.797154 Cl\n0.366233 0.413333 0.412640 Cl\n0.895703 0.149859 0.502757 Cl\n0.113668 0.321904 0.702845 Cl\n-0.113668 0.678096 0.297154 Cl\n0.633766 0.086667 0.912639 Cl\n0.104296 0.850141 0.497243 Cl\n0.104296 0.350140 0.002757 Cl\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu-K",
"density": 2.7992886105245955,
"density_atomic": 0.04032881310072519,
"volume": 495.92334765836097,
"volume_molar": 14.932601028845333,
"formula_full": "K4 Cu4 Cl12",
"formula_reduced": "KCuCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-97618",
"created_at": "2022-09-04T14:36:06.219756Z",
"updated_at": "2022-09-04T14:36:06.219776Z",
"structure_string": "Np8 S12\n1.0\n3.876281 0.000000 0.000000\n-0.000000 10.383823 0.000000\n0.000000 0.000000 10.563936\nNp S\n8 12\ndirect\n0.250000 0.316643 0.991871 Np\n0.750000 0.683357 0.008129 Np\n0.750000 0.816642 0.508129 Np\n0.250000 0.183357 0.491871 Np\n0.250000 0.508095 0.312794 Np\n0.750000 0.491904 0.687207 Np\n0.750000 0.008096 0.187206 Np\n0.250000 0.991904 0.812794 Np\n0.750000 0.796817 0.771772 S\n0.250000 0.203183 0.228228 S\n0.250000 0.944445 0.374986 S\n0.750000 0.055555 0.625015 S\n0.750000 0.444445 0.125014 S\n0.750000 0.130527 0.949432 S\n0.250000 0.630527 0.550568 S\n0.750000 0.369473 0.449432 S\n0.750000 0.703183 0.271772 S\n0.250000 0.869473 0.050568 S\n0.250000 0.555555 0.874986 S\n0.250000 0.296817 0.728228 S\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Np",
"S"
],
"chemical_system": "Np-S",
"density": 8.907056412994159,
"density_atomic": 0.04703614333241102,
"volume": 425.20492929569497,
"volume_molar": 12.803219680322613,
"formula_full": "Np8 S12",
"formula_reduced": "Np2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.889638000000001,
"spacegroup": 62
},
{
"id": "jvasp-22591",
"created_at": "2022-09-04T14:35:53.905803Z",
"updated_at": "2022-09-04T14:35:53.905822Z",
"structure_string": "Zn10 S10\n1.0\n3.840914 -0.000000 -0.000000\n-1.920457 3.326329 0.000000\n-0.000000 0.000000 31.401460\nZn S\n10 10\ndirect\n-0.000000 -0.000000 0.599872 Zn\n0.333332 0.666667 0.100279 Zn\n0.666666 0.333333 0.499943 Zn\n0.333332 0.666667 0.900048 Zn\n-0.000000 -0.000000 0.000119 Zn\n0.333332 0.666667 0.400024 Zn\n0.333332 0.666667 0.699792 Zn\n0.666666 0.333333 0.799885 Zn\n0.666666 0.333333 0.200176 Zn\n-0.000000 -0.000000 0.300102 Zn\n-0.000000 -0.000000 0.375030 S\n-0.000000 -0.000000 0.075203 S\n-0.000000 -0.000000 0.674799 S\n0.333332 0.666667 0.974942 S\n0.333332 0.666667 0.474947 S\n0.666666 0.333333 0.574874 S\n0.333332 0.666667 0.774712 S\n0.666666 0.333333 0.275101 S\n0.333332 0.666667 0.175181 S\n0.666666 0.333333 0.874973 S\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Zn",
"S"
],
"chemical_system": "S-Zn",
"density": 4.0344864351227985,
"density_atomic": 0.04985174552191633,
"volume": 401.1895629854605,
"volume_molar": 12.080100098706646,
"formula_full": "Zn10 S10",
"formula_reduced": "ZnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.000245,
"spacegroup": 156
},
{
"id": "jvasp-87241",
"created_at": "2022-09-04T14:35:54.819664Z",
"updated_at": "2022-09-04T14:35:54.819674Z",
"structure_string": "La4 Ga4 Se8 O4\n1.0\n5.975884 0.000000 0.000000\n0.000000 5.981657 0.000000\n0.000000 0.000000 12.333999\nLa Ga Se O\n4 4 8 4\ndirect\n0.754210 0.497416 0.095872 La\n0.254210 0.002584 0.095872 La\n0.254210 0.502584 0.904128 La\n0.754210 0.997417 0.904128 La\n0.658485 0.077206 0.397922 Ga\n0.158485 0.922795 0.602078 Ga\n0.658485 0.577206 0.602078 Ga\n0.158485 0.422795 0.397922 Ga\n0.255319 0.006748 0.781401 Se\n0.755319 0.493252 0.781401 Se\n0.750341 0.979021 0.587373 Se\n0.250342 0.520980 0.587373 Se\n0.250342 0.020980 0.412627 Se\n0.255319 0.506749 0.218599 Se\n0.755319 0.993252 0.218599 Se\n0.750341 0.479020 0.412627 Se\n0.500942 0.749394 0.001407 O\n0.000942 0.250607 0.998593 O\n0.000942 0.750607 0.001407 O\n0.500942 0.249394 0.998593 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"La",
"Ga",
"Se",
"O"
],
"chemical_system": "Ga-La-O-Se",
"density": 5.763247935110381,
"density_atomic": 0.04536306830307027,
"volume": 440.8872844839368,
"volume_molar": 13.275426432282156,
"formula_full": "La4 Ga4 Se8 O4",
"formula_reduced": "LaGaSe2O",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.0227935116666669,
"spacegroup": 29
},
{
"id": "jvasp-50873",
"created_at": "2022-09-04T14:36:08.276010Z",
"updated_at": "2022-09-04T14:36:08.276027Z",
"structure_string": "Li4 H4 Se2 O10\n1.0\n0.000000 5.828242 -0.076199\n5.048354 0.000000 0.000000\n0.000000 -2.035963 -8.103081\nLi H Se O\n4 4 2 10\ndirect\n0.322897 0.962099 -0.003422 Li\n0.860234 0.458838 0.421623 Li\n0.139767 0.958838 0.578377 Li\n0.677103 0.462100 0.003423 Li\n0.331511 0.911484 0.351263 H\n0.513842 0.598972 0.511965 H\n0.486158 0.098972 0.488035 H\n0.668489 0.411485 0.648738 H\n0.878533 0.961672 0.202713 Se\n0.121467 0.461672 0.797287 Se\n0.400506 0.926547 0.471574 O\n0.134932 0.894556 0.155164 O\n0.599495 0.426548 0.528426 O\n0.652657 0.828754 0.066310 O\n0.168034 0.787949 0.789558 O\n0.110363 0.338067 0.609786 O\n0.889637 0.838067 0.390214 O\n0.831966 0.287949 0.210442 O\n0.347343 0.328755 0.933690 O\n0.865068 0.394556 0.844836 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"H",
"Se",
"O"
],
"chemical_system": "H-Li-O-Se",
"density": 2.427699825635154,
"density_atomic": 0.08361190764624182,
"volume": 239.2003790251873,
"volume_molar": 7.202491761675146,
"formula_full": "Li4 H4 Se2 O10",
"formula_reduced": "Li2H2SeO5",
"formula_anonymous": "AB2C2D5",
"energy_above_hull": 2.2572120866666667,
"spacegroup": 4
}
]
}