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_anonymous&page=3493",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3491",
"results": [
{
"id": "jvasp-28948",
"created_at": "2022-09-04T14:38:11.528917Z",
"updated_at": "2022-09-04T14:38:11.528943Z",
"structure_string": "Te2 Mo1 W3 Se4 S2\n1.0\n3.347798 0.000000 -0.000000\n-1.673900 2.899265 -0.000001\n-0.000000 -0.000005 37.898862\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333351 0.666705 0.707753 Te\n0.333353 0.666707 0.607182 Te\n0.333311 0.666621 0.093929 Mo\n0.333311 0.666623 0.469646 W\n0.666686 0.333372 0.281815 W\n0.666689 0.333377 0.657553 W\n0.333352 0.666704 0.325961 Se\n0.666648 0.333294 0.050121 Se\n0.666646 0.333291 0.137856 Se\n0.333351 0.666703 0.237637 Se\n0.666648 0.333293 0.429470 S\n0.666647 0.333291 0.509824 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.789981328952611,
"density_atomic": 0.03262179980768341,
"volume": 367.8521746422354,
"volume_molar": 18.460479788063704,
"formula_full": "Te2 Mo1 W3 Se4 S2",
"formula_reduced": "Te2MoW3(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.124586241666667,
"spacegroup": 156
},
{
"id": "jvasp-91474",
"created_at": "2022-09-04T14:35:56.848785Z",
"updated_at": "2022-09-04T14:35:56.848811Z",
"structure_string": "K4 Hg4 S2 Cl8 O6\n1.0\n5.990227 0.000000 0.000000\n0.000000 8.973552 -3.349114\n0.000000 0.005078 10.212641\nK Hg S Cl O\n4 4 2 8 6\ndirect\n0.750000 0.603594 0.179949 K\n0.750000 0.129371 0.948901 K\n0.250000 0.396406 0.820051 K\n0.250000 0.870629 0.051100 K\n0.250000 0.417385 0.370728 Hg\n0.750000 0.114139 0.471220 Hg\n0.250000 0.885861 0.528780 Hg\n0.750000 0.582616 0.629272 Hg\n0.750000 0.688374 0.881989 S\n0.250000 0.311627 0.118011 S\n0.750000 0.276002 0.712568 Cl\n0.250000 0.723998 0.287432 Cl\n0.250000 0.588673 0.616892 Cl\n0.750000 0.980009 0.226265 Cl\n0.750000 0.833866 0.529117 Cl\n0.250000 0.019991 0.773735 Cl\n0.750000 0.411327 0.383109 Cl\n0.250000 0.166134 0.470884 Cl\n0.953890 0.636700 0.933819 O\n0.250000 0.149193 0.083412 O\n0.453890 0.363300 0.066181 O\n0.750000 0.850808 0.916588 O\n0.546111 0.636700 0.933819 O\n0.046110 0.363300 0.066181 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"K",
"Hg",
"S",
"Cl",
"O"
],
"chemical_system": "Cl-Hg-K-O-S",
"density": 4.241571238882365,
"density_atomic": 0.043710414523760656,
"volume": 549.0682314841416,
"volume_molar": 13.777359070174018,
"formula_full": "K4 Hg4 S2 Cl8 O6",
"formula_reduced": "K2Hg2SCl4O3",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 0.3325759975,
"spacegroup": 11
},
{
"id": "jvasp-28752",
"created_at": "2022-09-04T14:38:35.143050Z",
"updated_at": "2022-09-04T14:38:35.143080Z",
"structure_string": "Te2 Mo3 W1 Se2 S4\n1.0\n3.312770 -0.000000 -0.000000\n-1.656384 2.868891 -0.000174\n-0.000000 -0.002331 34.624733\nTe Mo W Se S\n2 3 1 2 4\ndirect\n0.333480 0.666958 0.719525 Te\n0.333324 0.666646 0.608957 Te\n0.333200 0.666400 0.099966 Mo\n0.666639 0.333276 0.277257 Mo\n0.666760 0.333519 0.664293 Mo\n0.333369 0.666735 0.461428 W\n0.666722 0.333442 0.412674 Se\n0.666688 0.333375 0.510178 Se\n0.333333 0.666666 0.321384 S\n0.666522 0.333042 0.055850 S\n0.666694 0.333386 0.144121 S\n0.333278 0.666555 0.233113 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.111918571914263,
"density_atomic": 0.036466113722298514,
"volume": 329.07263141293197,
"volume_molar": 16.51434755526895,
"formula_full": "Te2 Mo3 W1 Se2 S4",
"formula_reduced": "Te2Mo3W(SeS2)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.821477497222223,
"spacegroup": 156
},
{
"id": "jvasp-28953",
"created_at": "2022-09-04T14:38:34.921162Z",
"updated_at": "2022-09-04T14:38:34.921196Z",
"structure_string": "Te4 Mo1 W3 Se2 S2\n1.0\n3.403159 -0.000000 -0.000000\n-1.701579 2.947222 -0.000285\n-0.000000 -0.003739 40.309077\nTe Mo W Se S\n4 1 3 2 2\ndirect\n0.333402 0.666805 0.326910 Te\n0.666569 0.333137 0.423939 Te\n0.666691 0.333381 0.517373 Te\n0.333267 0.666535 0.233946 Te\n0.666669 0.333337 0.280441 Mo\n0.333282 0.666564 0.093825 W\n0.333299 0.666595 0.470664 W\n0.666751 0.333503 0.658007 W\n0.333469 0.666940 0.698891 Se\n0.333366 0.666734 0.617016 Se\n0.666563 0.333125 0.056573 S\n0.666670 0.333338 0.131165 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.6676355896373725,
"density_atomic": 0.029681326442139187,
"volume": 404.29459995303154,
"volume_molar": 20.28932491187538,
"formula_full": "Te4 Mo1 W3 Se2 S2",
"formula_reduced": "Te4MoW3(SeS)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.037766975,
"spacegroup": 156
},
{
"id": "jvasp-29168",
"created_at": "2022-09-04T14:38:35.847628Z",
"updated_at": "2022-09-04T14:38:35.847649Z",
"structure_string": "Te4 Mo3 W1 Se2 S2\n1.0\n3.408001 0.000000 -0.000000\n-1.704000 2.950978 0.000028\n-0.000000 -0.000308 45.423889\nTe Mo W Se S\n4 3 1 2 2\ndirect\n0.333383 0.666768 0.703811 Te\n0.666787 0.333573 0.423358 Te\n0.666541 0.333083 0.505974 Te\n0.333529 0.667058 0.621395 Te\n0.333207 0.666414 0.093954 Mo\n0.333377 0.666753 0.464800 Mo\n0.666754 0.333507 0.662632 Mo\n0.666660 0.333320 0.281622 W\n0.666572 0.333145 0.057748 Se\n0.666404 0.332809 0.130032 Se\n0.333305 0.666609 0.314933 S\n0.333479 0.666960 0.248490 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 4.376886264273489,
"density_atomic": 0.02626825640488761,
"volume": 456.8251434368981,
"volume_molar": 22.925544304034922,
"formula_full": "Te4 Mo3 W1 Se2 S2",
"formula_reduced": "Te4Mo3W(SeS)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.6392537916666665,
"spacegroup": 156
},
{
"id": "jvasp-57133",
"created_at": "2022-09-04T14:38:31.521207Z",
"updated_at": "2022-09-04T14:38:31.521228Z",
"structure_string": "Li2 Pr4 C4 N8 F6\n1.0\n6.594394 0.000000 0.000000\n-3.297197 5.278673 -2.481479\n0.000000 0.015921 8.535882\nLi Pr C N F\n2 4 4 8 6\ndirect\n0.905134 -0.000000 0.750000 Li\n0.094865 -0.000000 0.250000 Li\n0.290577 0.572966 0.667852 Pr\n0.709422 0.427033 0.332147 Pr\n0.717610 0.427033 0.832147 Pr\n0.282389 0.572966 0.167853 Pr\n0.274109 0.047826 0.952974 C\n0.773715 0.047826 0.452974 C\n0.226283 0.952173 0.547025 C\n0.725889 0.952173 0.047025 C\n0.712084 0.827250 0.366966 N\n0.163372 0.727351 0.463662 N\n0.884834 0.172750 0.133033 N\n0.836627 0.272648 0.536338 N\n0.287915 0.172750 0.633033 N\n0.563977 0.727351 0.963662 N\n0.436022 0.272648 0.036338 N\n0.115165 0.827249 0.866966 N\n0.307182 0.370456 0.365377 F\n0.393884 -0.000000 0.250000 F\n0.692816 0.629543 0.634623 F\n0.606115 -0.000000 0.750000 F\n0.936725 0.629543 0.134623 F\n0.063273 0.370456 0.865377 F\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Li",
"Pr",
"C",
"N",
"F"
],
"chemical_system": "C-F-Li-N-Pr",
"density": 4.755057481201446,
"density_atomic": 0.08070167688131845,
"volume": 297.3915899578505,
"volume_molar": 7.462225064859909,
"formula_full": "Li2 Pr4 C4 N8 F6",
"formula_reduced": "LiPr2C2N4F3",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.5248119622916656,
"spacegroup": 15
},
{
"id": "jvasp-29175",
"created_at": "2022-09-04T14:38:34.979788Z",
"updated_at": "2022-09-04T14:38:34.979815Z",
"structure_string": "Te2 Mo1 W3 Se4 S2\n1.0\n3.353544 -0.000002 0.000005\n-1.676773 2.904235 0.000009\n0.000061 0.000149 37.882285\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333357 0.666717 0.707742 Te\n0.333356 0.666709 0.607242 Te\n0.333316 0.666627 0.093934 Mo\n0.333318 0.666636 0.469611 W\n0.666679 0.333361 0.281809 W\n0.666688 0.333380 0.657595 W\n0.666641 0.333281 0.050206 Se\n0.666639 0.333280 0.425396 Se\n0.666649 0.333297 0.137878 Se\n0.666647 0.333293 0.513761 Se\n0.333359 0.666716 0.322066 S\n0.333348 0.666701 0.241510 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.77269629651336,
"density_atomic": 0.03252441281524478,
"volume": 368.95362471771926,
"volume_molar": 18.515755516352673,
"formula_full": "Te2 Mo1 W3 Se4 S2",
"formula_reduced": "Te2MoW3(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.124646241666667,
"spacegroup": 156
},
{
"id": "jvasp-28931",
"created_at": "2022-09-04T14:37:38.174000Z",
"updated_at": "2022-09-04T14:37:38.174013Z",
"structure_string": "Te2 Mo1 W3 Se4 S2\n1.0\n3.344920 0.000004 -0.000045\n-1.672457 2.896778 0.000045\n-0.000505 0.000263 35.149371\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333416 0.666733 0.331471 Te\n0.333386 0.666758 0.223261 Te\n0.666737 0.333412 0.277385 Mo\n0.333259 0.666744 0.085458 W\n0.333256 0.666443 0.476189 W\n0.666756 0.333416 0.663904 W\n0.333400 0.666685 0.711528 Se\n0.666579 0.333104 0.428490 Se\n0.666606 0.333120 0.523862 Se\n0.333434 0.666798 0.616227 Se\n0.666578 0.333402 0.042098 S\n0.666578 0.333378 0.128877 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 6.253622836253596,
"density_atomic": 0.03523403973980101,
"volume": 340.57973733975734,
"volume_molar": 17.091825985532058,
"formula_full": "Te2 Mo1 W3 Se4 S2",
"formula_reduced": "Te2MoW3(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.122125408333334,
"spacegroup": 156
},
{
"id": "jvasp-28783",
"created_at": "2022-09-04T14:37:34.667710Z",
"updated_at": "2022-09-04T14:37:34.667725Z",
"structure_string": "Te2 Mo3 W1 Se4 S2\n1.0\n3.345587 -0.000111 0.000497\n-1.672889 2.897436 -0.000031\n0.005234 0.002665 35.320536\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.667089 0.333355 0.419115 Te\n0.666653 0.333312 0.526823 Te\n0.332877 0.666681 0.089859 Mo\n0.333426 0.666582 0.472948 Mo\n0.666505 0.333334 0.275851 Mo\n0.667112 0.333348 0.664232 W\n0.332972 0.666568 0.323068 Se\n0.666384 0.333391 0.042716 Se\n0.665960 0.333269 0.137061 Se\n0.333435 0.666796 0.228657 Se\n0.333601 0.666627 0.707381 S\n0.333995 0.666754 0.621034 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.3681530025823525,
"density_atomic": 0.03504903880155691,
"volume": 342.37743488323423,
"volume_molar": 17.182042549288088,
"formula_full": "Te2 Mo3 W1 Se4 S2",
"formula_reduced": "Te2Mo3W(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.722742225,
"spacegroup": 156
},
{
"id": "jvasp-28983",
"created_at": "2022-09-04T14:37:37.283466Z",
"updated_at": "2022-09-04T14:37:37.283491Z",
"structure_string": "Te2 Mo1 W3 Se2 S4\n1.0\n3.321124 0.000005 0.000001\n-1.660557 2.876157 0.000051\n0.000013 0.000704 38.914866\nTe Mo W Se S\n2 1 3 2 4\ndirect\n0.666677 0.333355 0.419065 Te\n0.666666 0.333338 0.517943 Te\n0.666669 0.333340 0.281299 Mo\n0.333317 0.666622 0.093947 W\n0.333336 0.666672 0.468576 W\n0.666643 0.333291 0.659124 W\n0.333310 0.666623 0.702014 Se\n0.333324 0.666651 0.615919 Se\n0.333378 0.666759 0.320579 S\n0.666643 0.333297 0.054747 S\n0.666636 0.333278 0.133353 S\n0.333390 0.666783 0.242183 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.310787320396054,
"density_atomic": 0.03228253638932135,
"volume": 371.71800428820853,
"volume_molar": 18.654484540415627,
"formula_full": "Te2 Mo1 W3 Se2 S4",
"formula_reduced": "Te2MoW3(SeS2)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.2222348472222215,
"spacegroup": 156
},
{
"id": "jvasp-29143",
"created_at": "2022-09-04T14:37:35.785772Z",
"updated_at": "2022-09-04T14:37:35.785803Z",
"structure_string": "Te2 Mo3 W1 Se2 S4\n1.0\n3.311064 0.000000 -0.000000\n-1.655533 2.867469 0.000035\n-0.000001 0.000515 34.579978\nTe Mo W Se S\n2 3 1 2 4\ndirect\n0.666686 0.333371 0.036496 Te\n0.666637 0.333276 0.147335 Te\n0.333330 0.666660 0.091834 Mo\n0.333327 0.666653 0.469360 Mo\n0.666662 0.333326 0.286501 Mo\n0.666676 0.333353 0.655168 W\n0.666659 0.333317 0.420834 Se\n0.666658 0.333315 0.517916 Se\n0.333328 0.666656 0.330698 S\n0.333343 0.666684 0.699558 S\n0.333347 0.666692 0.242320 S\n0.333345 0.666690 0.610725 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.123711546238581,
"density_atomic": 0.036550239464284595,
"volume": 328.315222441317,
"volume_molar": 16.476337359936014,
"formula_full": "Te2 Mo3 W1 Se2 S4",
"formula_reduced": "Te2Mo3W(SeS2)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.820166663888889,
"spacegroup": 156
},
{
"id": "jvasp-28590",
"created_at": "2022-09-04T14:37:40.385461Z",
"updated_at": "2022-09-04T14:37:40.385471Z",
"structure_string": "Te2 Mo3 W1 Se4 S2\n1.0\n3.350385 0.000035 -0.001331\n-1.675163 2.901332 -0.001441\n-0.013890 -0.025463 34.939309\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.334532 0.667510 0.331951 Te\n0.332210 0.666364 0.222522 Te\n0.333724 0.666438 0.084853 Mo\n0.333088 0.666798 0.476517 Mo\n0.666579 0.333329 0.664304 Mo\n0.666676 0.333581 0.277253 W\n0.333995 0.667512 0.711908 Se\n0.665650 0.332507 0.428840 Se\n0.667099 0.334266 0.524175 Se\n0.332466 0.665719 0.616651 Se\n0.666155 0.331917 0.041490 S\n0.667827 0.334069 0.128283 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.411544611218853,
"density_atomic": 0.03533234558771429,
"volume": 339.63213594776516,
"volume_molar": 17.04427107747415,
"formula_full": "Te2 Mo3 W1 Se4 S2",
"formula_reduced": "Te2Mo3W(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.725487225,
"spacegroup": 156
}
]
}