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=volume&page=4356",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=4354",
"results": [
{
"id": "jvasp-113012",
"created_at": "2022-09-04T14:38:44.779142Z",
"updated_at": "2022-09-04T14:38:44.779166Z",
"structure_string": "Nd6 In8 Ge2\n1.0\n7.348421 -0.005224 -4.186799\n-2.484400 6.915713 -4.186799\n0.003677 0.005224 8.457456\nNd In Ge\n6 8 2\ndirect\n0.750000 0.750000 -0.000000 Nd\n0.250000 0.250000 -0.000000 Nd\n0.663239 0.163238 0.826478 Nd\n0.336761 0.836761 0.173522 Nd\n0.163239 0.336761 0.500000 Nd\n0.836761 0.663239 0.500000 Nd\n0.323257 0.823256 0.787461 In\n0.676743 0.176744 0.212539 In\n0.035795 0.535795 0.212538 In\n0.823257 0.035795 0.500000 In\n0.464205 0.676743 0.500000 In\n0.964205 0.464205 0.787462 In\n0.176743 0.964204 0.500000 In\n0.535795 0.323257 0.500000 In\n0.500000 0.500000 -0.000000 Ge\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Nd",
"In",
"Ge"
],
"chemical_system": "Ge-In-Nd",
"density": 7.450041924104616,
"density_atomic": 0.0372079069249718,
"volume": 430.0161262030497,
"volume_molar": 16.185110256654312,
"formula_full": "Nd6 In8 Ge2",
"formula_reduced": "Nd3In4Ge",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.4691687912500001,
"spacegroup": 140
},
{
"id": "jvasp-59656",
"created_at": "2022-09-04T14:37:34.258539Z",
"updated_at": "2022-09-04T14:37:34.258560Z",
"structure_string": "In8 As8\n1.0\n7.548247 0.000000 -0.000000\n0.000000 7.548247 -0.000000\n-0.000000 0.000000 7.548247\nIn As\n8 8\ndirect\n0.340946 0.159054 0.840946 In\n0.159054 0.840946 0.340946 In\n0.840946 0.340946 0.159054 In\n0.659055 0.659055 0.659055 In\n0.659055 0.840946 0.159054 In\n0.840946 0.159054 0.659055 In\n0.159054 0.659055 0.840946 In\n0.340946 0.340946 0.340946 In\n0.138041 0.361959 0.638041 As\n0.361959 0.638041 0.138041 As\n0.638041 0.138041 0.361959 As\n0.861959 0.861959 0.861959 As\n0.861959 0.638041 0.361959 As\n0.638041 0.361959 0.861959 As\n0.361959 0.861959 0.638041 As\n0.138041 0.138041 0.138041 As\n",
"nsites": 16,
"nelements": 2,
"elements": [
"In",
"As"
],
"chemical_system": "As-In",
"density": 5.860825028048961,
"density_atomic": 0.037203317916596104,
"volume": 430.0691684507668,
"volume_molar": 16.18710668091668,
"formula_full": "In8 As8",
"formula_reduced": "InAs",
"formula_anonymous": "AB",
"energy_above_hull": 0.5464108599999999,
"spacegroup": 205
},
{
"id": "jvasp-97451",
"created_at": "2022-09-04T14:36:19.150327Z",
"updated_at": "2022-09-04T14:36:19.150362Z",
"structure_string": "Na6 Sc4 B6 O18\n1.0\n7.388136 0.016974 3.856449\n2.344671 7.006237 3.856449\n0.023522 0.016974 8.334038\nNa Sc B O\n6 4 6 18\ndirect\n0.917895 0.582106 0.250000 Na\n0.082106 0.417894 0.750000 Na\n0.582106 0.249999 0.917895 Na\n0.750000 0.082105 0.417894 Na\n0.250000 0.917894 0.582106 Na\n0.417894 0.750000 0.082106 Na\n0.827436 0.827435 0.827436 Sc\n0.172565 0.172565 0.172565 Sc\n0.672565 0.672564 0.672565 Sc\n0.327435 0.327435 0.327436 Sc\n0.090666 0.750000 0.409334 B\n0.250000 0.590666 0.909335 B\n0.750000 0.409334 0.090666 B\n0.909335 0.249999 0.590666 B\n0.590666 0.909334 0.250000 B\n0.409334 0.090665 0.750000 B\n0.314995 0.156768 0.904457 O\n0.429570 0.070430 0.250000 O\n0.070430 0.250000 0.429570 O\n0.404456 0.656768 0.814996 O\n0.570430 0.929570 0.750001 O\n0.685005 0.843232 0.095544 O\n0.185005 0.595544 0.343232 O\n0.343232 0.185004 0.595544 O\n0.156768 0.904456 0.314996 O\n0.595544 0.343232 0.185005 O\n0.750000 0.570429 0.929571 O\n0.656768 0.814995 0.404456 O\n0.904457 0.314995 0.156768 O\n0.843232 0.095543 0.685005 O\n0.814996 0.404456 0.656769 O\n0.095544 0.685004 0.843232 O\n0.250000 0.429570 0.070430 O\n0.929570 0.750000 0.570430 O\n",
"nsites": 34,
"nelements": 4,
"elements": [
"Na",
"Sc",
"B",
"O"
],
"chemical_system": "B-Na-O-Sc",
"density": 2.5891384638524872,
"density_atomic": 0.07905152226030646,
"volume": 430.0992444907309,
"volume_molar": 7.617994679684811,
"formula_full": "Na6 Sc4 B6 O18",
"formula_reduced": "Na3Sc2(BO3)3",
"formula_anonymous": "A2B3C3D9",
"energy_above_hull": 2.648969808823529,
"spacegroup": 167
},
{
"id": "jvasp-56826",
"created_at": "2022-09-04T14:37:27.655589Z",
"updated_at": "2022-09-04T14:37:27.655621Z",
"structure_string": "Er10 Co4 Te4\n1.0\n3.898650 0.000000 0.000000\n-1.949325 7.420036 0.000000\n0.000000 0.000000 14.868651\nEr Co Te\n10 4 4\ndirect\n0.392717 0.785431 0.250000 Er\n0.259683 0.519364 0.867490 Er\n0.740319 0.480637 0.132510 Er\n0.962590 0.925178 0.627137 Er\n0.037411 0.074822 0.372863 Er\n0.740319 0.480637 0.367490 Er\n0.962590 0.925178 0.872863 Er\n0.037411 0.074822 0.127137 Er\n0.259683 0.519364 0.632510 Er\n0.607285 0.214569 0.750000 Er\n0.585000 0.169999 0.250000 Co\n0.415002 0.830001 0.750000 Co\n0.180269 0.360538 0.250000 Co\n0.819732 0.639462 0.750000 Co\n0.618980 0.237960 0.537841 Te\n0.381021 0.762041 0.037841 Te\n0.381021 0.762041 0.462159 Te\n0.618980 0.237960 0.962159 Te\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Er",
"Co",
"Te"
],
"chemical_system": "Co-Er-Te",
"density": 9.337774115727612,
"density_atomic": 0.04184857523563435,
"volume": 430.1221701969169,
"volume_molar": 14.390312516236168,
"formula_full": "Er10 Co4 Te4",
"formula_reduced": "Er5(CoTe)2",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.912754148148148,
"spacegroup": 63
},
{
"id": "jvasp-117120",
"created_at": "2022-09-04T14:38:50.684107Z",
"updated_at": "2022-09-04T14:38:50.684135Z",
"structure_string": "Sm12 Ni4\n1.0\n6.368646 -0.000000 0.000000\n0.000000 6.918319 0.000000\n-0.000000 0.000000 9.763288\nSm Ni\n12 4\ndirect\n0.325887 0.178564 0.565543 Sm\n0.174114 0.678564 0.934457 Sm\n0.674114 0.821436 0.065543 Sm\n0.825887 0.321436 0.434457 Sm\n0.674114 0.821436 0.434457 Sm\n0.825887 0.321436 0.065543 Sm\n0.325887 0.178564 0.934457 Sm\n0.174114 0.678564 0.565543 Sm\n0.855783 0.032021 0.750000 Sm\n0.644218 0.532021 0.750000 Sm\n0.144217 0.967979 0.250000 Sm\n0.355783 0.467979 0.250000 Sm\n0.066041 0.387328 0.750000 Ni\n0.433959 0.887328 0.750000 Ni\n0.933959 0.612672 0.250000 Ni\n0.566042 0.112672 0.250000 Ni\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sm",
"Ni"
],
"chemical_system": "Ni-Sm",
"density": 7.871227519899943,
"density_atomic": 0.03719428286780295,
"volume": 430.1736386978527,
"volume_molar": 16.191038771749074,
"formula_full": "Sm12 Ni4",
"formula_reduced": "Sm3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 1.3413447562499998,
"spacegroup": 62
},
{
"id": "jvasp-89763",
"created_at": "2022-09-04T14:35:40.900985Z",
"updated_at": "2022-09-04T14:35:40.901006Z",
"structure_string": "Tl2 H12 N6 O24\n1.0\n5.995813 3.461684 3.454446\n-5.995813 3.461684 3.454446\n-0.000000 -6.923369 3.454446\nTl H N O\n2 12 6 24\ndirect\n0.754858 0.754858 0.754859 Tl\n0.245143 0.245143 0.245143 Tl\n0.638800 0.325737 0.373989 H\n0.373988 0.638800 0.325738 H\n0.325737 0.373988 0.638801 H\n0.361201 0.674264 0.626014 H\n0.626013 0.361201 0.674265 H\n0.674264 0.626013 0.361202 H\n0.155830 0.590519 0.302974 H\n0.302973 0.155830 0.590520 H\n0.409482 0.697027 0.844172 H\n0.844171 0.409482 0.697028 H\n0.697027 0.844171 0.409482 H\n0.590519 0.302973 0.155831 H\n0.337738 0.894398 0.132446 N\n0.894398 0.132445 0.337739 N\n0.132445 0.337738 0.894399 N\n0.662262 0.105602 0.867556 N\n0.867556 0.662263 0.105603 N\n0.105602 0.867555 0.662263 N\n0.700211 0.651577 0.063551 O\n0.352448 0.271803 0.557765 O\n0.442237 0.647552 0.728199 O\n0.728198 0.442237 0.647553 O\n0.647552 0.728198 0.442238 O\n0.936451 0.299790 0.348424 O\n0.348424 0.936451 0.299791 O\n0.299790 0.348424 0.936452 O\n0.063550 0.700211 0.651578 O\n0.651577 0.063550 0.700212 O\n0.005634 0.035142 0.292749 O\n0.632048 0.250775 0.944374 O\n0.035142 0.292748 0.005634 O\n0.994367 0.964859 0.707254 O\n0.707252 0.994367 0.964860 O\n0.964859 0.707252 0.994368 O\n0.749226 0.055628 0.367953 O\n0.367953 0.749226 0.055629 O\n0.055628 0.367953 0.749226 O\n0.250775 0.944373 0.632049 O\n0.271803 0.557764 0.352449 O\n0.944373 0.632048 0.250776 O\n0.292748 0.005634 0.035142 O\n0.557764 0.352448 0.271804 O\n",
"nsites": 44,
"nelements": 4,
"elements": [
"Tl",
"H",
"N",
"O"
],
"chemical_system": "H-N-O-Tl",
"density": 3.4310795222071966,
"density_atomic": 0.1022792361504588,
"volume": 430.19484360709737,
"volume_molar": 5.887940687336651,
"formula_full": "Tl2 H12 N6 O24",
"formula_reduced": "TlH6(NO4)3",
"formula_anonymous": "AB3C6D12",
"energy_above_hull": 3.3889851977272727,
"spacegroup": 148
},
{
"id": "jvasp-112642",
"created_at": "2022-09-04T14:38:42.670951Z",
"updated_at": "2022-09-04T14:38:42.670971Z",
"structure_string": "Sr4 Al6 Mo1 O16\n1.0\n7.740985 0.003553 -2.817165\n-3.794571 6.747154 -2.817165\n-0.002077 -0.003553 8.237673\nSr Al Mo O\n4 6 1 16\ndirect\n0.491622 0.991622 0.983244 Sr\n0.008377 0.991622 0.499999 Sr\n0.008377 0.508377 0.016754 Sr\n0.491622 0.508377 0.499999 Sr\n0.747593 0.495715 0.251876 Al\n0.250000 0.750000 0.499999 Al\n0.504284 0.756161 0.251876 Al\n0.749999 0.250000 0.499999 Al\n0.504284 0.252406 0.748122 Al\n0.243838 0.495716 0.748122 Al\n0.000000 0.000000 0.000000 Mo\n0.338003 0.661996 -0.000001 O\n0.045364 0.891842 0.153519 O\n0.108157 0.954636 0.846479 O\n0.338003 0.338004 0.676006 O\n0.668064 0.333301 0.334762 O\n0.348790 0.695007 0.346215 O\n0.997424 0.651209 0.346214 O\n0.661996 0.338003 -0.000001 O\n0.661996 0.661996 0.323991 O\n0.998538 0.333301 0.665235 O\n0.348790 0.002575 0.653783 O\n0.108157 0.261677 0.153520 O\n0.304992 0.651209 0.653783 O\n0.666698 0.001461 0.334762 O\n0.666698 0.331935 0.665236 O\n0.738322 0.891842 0.846478 O\n",
"nsites": 27,
"nelements": 4,
"elements": [
"Sr",
"Al",
"Mo",
"O"
],
"chemical_system": "Al-Mo-O-Sr",
"density": 3.3360788275284077,
"density_atomic": 0.06276053582259966,
"volume": 430.20665209613264,
"volume_molar": 9.595425980782444,
"formula_full": "Sr4 Al6 Mo1 O16",
"formula_reduced": "Sr4Al6MoO16",
"formula_anonymous": "AB4C6D16",
"energy_above_hull": 2.3702653311111117,
"spacegroup": 119
},
{
"id": "jvasp-122067",
"created_at": "2022-09-04T14:38:52.674889Z",
"updated_at": "2022-09-04T14:38:52.674917Z",
"structure_string": "Tl8 Cu2 Te2 O12\n1.0\n5.750879 0.055614 1.706718\n0.552734 8.103026 3.394754\n-0.004599 0.031457 9.249604\nTl Cu Te O\n8 2 2 12\ndirect\n0.919960 0.110293 0.797741 Tl\n0.080039 0.889707 0.202259 Tl\n0.873882 0.254073 0.345412 Tl\n0.126118 0.745928 0.654588 Tl\n0.273080 0.390073 0.465863 Tl\n0.726919 0.609927 0.534136 Tl\n0.509285 0.923939 0.763050 Tl\n0.490714 0.076062 0.236950 Tl\n0.776065 0.444511 0.944281 Cu\n0.223935 0.555489 0.055718 Cu\n0.658711 0.668342 0.135487 Te\n0.341288 0.331658 0.864512 Te\n0.631126 0.256300 0.953457 O\n0.270321 0.108234 0.920510 O\n0.729678 0.891766 0.079489 O\n0.536944 0.347283 0.652413 O\n0.463055 0.652717 0.347586 O\n0.837126 0.665973 0.920070 O\n0.162873 0.334028 0.079929 O\n0.937794 0.574612 0.228585 O\n0.062205 0.425388 0.771414 O\n0.402553 0.560158 0.833286 O\n0.597446 0.439842 0.166714 O\n0.368874 0.743700 0.046543 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Tl",
"Cu",
"Te",
"O"
],
"chemical_system": "Cu-O-Te-Tl",
"density": 8.527508743536163,
"density_atomic": 0.0557852727118647,
"volume": 430.2210750848504,
"volume_molar": 10.795216133664576,
"formula_full": "Tl8 Cu2 Te2 O12",
"formula_reduced": "Tl4CuTeO6",
"formula_anonymous": "ABC4D6",
"energy_above_hull": null,
"spacegroup": 2
},
{
"id": "jvasp-122120",
"created_at": "2022-09-04T14:38:55.401783Z",
"updated_at": "2022-09-04T14:38:55.401809Z",
"structure_string": "K2 Sb2 Cl12\n1.0\n6.614146 0.098111 1.116827\n3.609127 5.543533 1.116827\n-0.127773 -0.070511 11.820453\nK Sb Cl\n2 2 12\ndirect\n0.919220 0.080781 0.750000 K\n0.080782 0.919219 0.250000 K\n0.500001 -0.000000 0.500000 Sb\n0.000000 0.500000 0.000000 Sb\n0.470280 0.679751 0.611571 Cl\n0.529722 0.320248 0.388429 Cl\n0.320250 0.529721 0.888429 Cl\n0.679752 0.470279 0.111571 Cl\n0.387875 0.203550 0.673602 Cl\n0.612127 0.796450 0.326398 Cl\n0.796452 0.612125 0.826398 Cl\n0.203550 0.387874 0.173602 Cl\n0.784600 0.926302 0.031848 Cl\n0.215401 0.073697 0.968153 Cl\n0.073697 0.215401 0.468153 Cl\n0.926305 0.784599 0.531848 Cl\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"Sb",
"Cl"
],
"chemical_system": "Cl-K-Sb",
"density": 2.883725558398508,
"density_atomic": 0.03718908556433971,
"volume": 430.233756953203,
"volume_molar": 16.193301525473856,
"formula_full": "K2 Sb2 Cl12",
"formula_reduced": "KSbCl6",
"formula_anonymous": "ABC6",
"energy_above_hull": null,
"spacegroup": 15
},
{
"id": "jvasp-99459",
"created_at": "2022-09-04T14:36:37.759109Z",
"updated_at": "2022-09-04T14:36:37.759121Z",
"structure_string": "K2 In1 As1 I6\n1.0\n7.338795 -0.000000 4.237055\n2.446265 6.919082 4.237055\n-0.000000 0.000000 8.474110\nK In As I\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.499999 0.500000 0.500001 In\n0.000000 0.000000 0.000000 As\n0.759202 0.240797 0.240798 I\n0.240797 0.240797 0.759203 I\n0.240796 0.759203 0.759204 I\n0.240796 0.759203 0.240798 I\n0.759202 0.240797 0.759204 I\n0.759202 0.759203 0.240798 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"In",
"As",
"I"
],
"chemical_system": "As-I-In-K",
"density": 3.972375808833954,
"density_atomic": 0.02323981512439015,
"volume": 430.29602199825655,
"volume_molar": 25.913032129415573,
"formula_full": "K2 In1 As1 I6",
"formula_reduced": "K2InAsI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-34767",
"created_at": "2022-09-04T14:38:32.303525Z",
"updated_at": "2022-09-04T14:38:32.303536Z",
"structure_string": "Sc7 Cl12\n1.0\n7.686825 -0.001858 -2.411273\n-3.283013 6.950476 -2.411272\n-0.001176 -0.001858 8.056148\nSc Cl\n7 12\ndirect\n0.312306 0.031217 0.104978 Sc\n0.031217 0.104977 0.312306 Sc\n0.687694 0.968783 0.895023 Sc\n0.895023 0.687693 0.968783 Sc\n0.968783 0.895022 0.687695 Sc\n0.500000 0.500000 0.500000 Sc\n0.104978 0.312306 0.031218 Sc\n0.225606 0.684516 0.075988 Cl\n0.684516 0.075987 0.225606 Cl\n0.613193 0.844873 0.533348 Cl\n0.315484 0.924013 0.774395 Cl\n0.075987 0.225606 0.684516 Cl\n0.466653 0.386807 0.155127 Cl\n0.155127 0.466653 0.386808 Cl\n0.386807 0.155127 0.466653 Cl\n0.533347 0.613193 0.844874 Cl\n0.844873 0.533347 0.613193 Cl\n0.774394 0.315484 0.924013 Cl\n0.924014 0.774394 0.315485 Cl\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Sc",
"Cl"
],
"chemical_system": "Cl-Sc",
"density": 2.8561806590840324,
"density_atomic": 0.0441553879119565,
"volume": 430.2985637423227,
"volume_molar": 13.638518524642631,
"formula_full": "Sc7 Cl12",
"formula_reduced": "Sc7Cl12",
"formula_anonymous": "A7B12",
"energy_above_hull": 1.1897429242105262,
"spacegroup": 148
},
{
"id": "jvasp-96811",
"created_at": "2022-09-04T14:36:11.682211Z",
"updated_at": "2022-09-04T14:36:11.682231Z",
"structure_string": "Li2 U2 P2 H16 O20\n1.0\n6.902416 -0.000000 0.000000\n0.000000 6.902416 0.000000\n0.000000 -0.000000 9.031691\nLi U P H O\n2 2 2 16 20\ndirect\n0.750000 0.250000 0.500000 Li\n0.250000 0.750000 0.500000 Li\n0.250000 0.250000 0.104302 U\n0.750000 0.750000 0.895698 U\n0.750000 0.250000 0.000000 P\n0.250000 0.750000 0.000000 P\n0.584106 0.895692 0.385392 H\n0.424842 0.835312 0.270933 H\n0.835312 0.075158 0.270933 H\n0.075158 0.664689 0.270933 H\n0.084105 0.395692 0.614608 H\n0.604309 0.584106 0.385392 H\n0.164688 0.924842 0.729066 H\n0.104308 0.084105 0.614608 H\n0.575159 0.164688 0.729066 H\n0.924842 0.335312 0.729066 H\n0.895692 0.915895 0.385392 H\n0.664689 0.424842 0.270933 H\n0.395692 0.415895 0.614608 H\n0.915895 0.604309 0.385392 H\n0.335312 0.575159 0.729066 H\n0.415895 0.104308 0.614608 H\n0.750000 0.750000 0.693916 O\n0.250000 0.250000 0.306084 O\n0.471104 0.806931 0.372538 O\n0.078835 0.805048 0.897447 O\n0.028897 0.693070 0.372538 O\n0.578835 0.305048 0.102552 O\n0.806931 0.028897 0.372538 O\n0.693070 0.471104 0.372538 O\n0.971104 0.306931 0.627462 O\n0.421166 0.694952 0.897447 O\n0.750000 0.750000 0.097280 O\n0.528897 0.193069 0.627462 O\n0.193069 0.971104 0.627462 O\n0.305048 0.921166 0.102552 O\n0.921166 0.194952 0.102552 O\n0.250000 0.250000 0.902720 O\n0.194952 0.578835 0.102552 O\n0.694952 0.078835 0.897447 O\n0.306931 0.528897 0.627462 O\n0.805048 0.421166 0.897447 O\n",
"nsites": 42,
"nelements": 5,
"elements": [
"Li",
"U",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P-U",
"density": 3.426824776108309,
"density_atomic": 0.09760632456656529,
"volume": 430.29998503177893,
"volume_molar": 6.169826378303013,
"formula_full": "Li2 U2 P2 H16 O20",
"formula_reduced": "LiUP(H4O5)2",
"formula_anonymous": "ABCD8E10",
"energy_above_hull": 3.1941422142857148,
"spacegroup": 85
}
]
}