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=937",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=935",
"results": [
{
"id": "jvasp-109396",
"created_at": "2022-09-04T14:37:56.296882Z",
"updated_at": "2022-09-04T14:37:56.296909Z",
"structure_string": "K1 Rb2 Mo1 O3 F3\n1.0\n5.535782 -0.002443 3.227467\n1.983020 5.156666 3.039392\n0.010985 -0.015951 6.266859\nK Rb Mo O F\n1 2 1 3 3\ndirect\n0.503817 0.503818 0.496183 K\n0.762202 0.762204 0.737797 Rb\n0.262202 0.262203 0.237797 Rb\n0.019627 0.019628 0.980373 Mo\n0.180166 0.774318 0.819833 O\n0.212302 0.212304 0.787697 O\n0.774316 0.180168 0.225683 O\n0.227210 0.781833 0.218167 F\n0.776318 0.776320 0.223681 F\n0.781831 0.227212 0.772790 F\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Rb",
"Mo",
"O",
"F"
],
"chemical_system": "F-K-Mo-O-Rb",
"density": 3.814389979474454,
"density_atomic": 0.055894453990086634,
"volume": 178.90862663715413,
"volume_molar": 10.774129327872277,
"formula_full": "K1 Rb2 Mo1 O3 F3",
"formula_reduced": "KRb2Mo(OF)3",
"formula_anonymous": "ABC2D3E3",
"energy_above_hull": 0.93519552475,
"spacegroup": 42
},
{
"id": "jvasp-99978",
"created_at": "2022-09-04T14:36:48.446178Z",
"updated_at": "2022-09-04T14:36:48.446202Z",
"structure_string": "K1 Rb2 W1 O3 F3\n1.0\n5.551323 0.008158 3.195311\n1.955675 5.178552 3.103052\n0.015882 -0.022838 6.298366\nK Rb W O F\n1 2 1 3 3\ndirect\n0.503402 0.503402 0.496598 K\n0.761937 0.761937 0.738063 Rb\n0.261937 0.261937 0.238063 Rb\n0.018190 0.018190 0.981810 W\n0.183792 0.773883 0.816209 O\n0.213855 0.213855 0.786145 O\n0.773883 0.183791 0.226117 O\n0.223751 0.780693 0.219306 F\n0.778561 0.778561 0.221439 F\n0.780693 0.223751 0.776250 F\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Rb",
"W",
"O",
"F"
],
"chemical_system": "F-K-O-Rb-W",
"density": 4.577945229108582,
"density_atomic": 0.05526325345490146,
"volume": 180.95206805297255,
"volume_molar": 10.897188246280997,
"formula_full": "K1 Rb2 W1 O3 F3",
"formula_reduced": "KRb2W(OF)3",
"formula_anonymous": "ABC2D3E3",
"energy_above_hull": 1.1602499347500002,
"spacegroup": 42
},
{
"id": "jvasp-102745",
"created_at": "2022-09-04T14:36:38.513046Z",
"updated_at": "2022-09-04T14:36:38.513065Z",
"structure_string": "K2 Na1 Mo1 O3 F3\n1.0\n5.200870 0.004903 3.014023\n1.853095 4.845686 2.873257\n0.012994 -0.018788 5.887280\nK Na Mo O F\n2 1 1 3 3\ndirect\n0.760609 0.760610 0.739391 K\n0.260609 0.260610 0.239390 K\n0.503250 0.503251 0.496750 Na\n0.021288 0.021289 0.978711 Mo\n0.196141 0.763245 0.803859 O\n0.225936 0.225937 0.774064 O\n0.763244 0.196142 0.236756 O\n0.240170 0.766007 0.233994 F\n0.762737 0.762738 0.237262 F\n0.766006 0.240171 0.759829 F\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Na",
"Mo",
"O",
"F"
],
"chemical_system": "F-K-Mo-Na-O",
"density": 3.382822645191985,
"density_atomic": 0.06742966057377298,
"volume": 148.3026892751339,
"volume_molar": 8.930996699013987,
"formula_full": "K2 Na1 Mo1 O3 F3",
"formula_reduced": "K2NaMo(OF)3",
"formula_anonymous": "ABC2D3E3",
"energy_above_hull": 0.9626102247500002,
"spacegroup": 42
},
{
"id": "jvasp-50980",
"created_at": "2022-09-04T14:37:00.309037Z",
"updated_at": "2022-09-04T14:37:00.309054Z",
"structure_string": "Li3 Zr1 Nb1 Te2 O12\n1.0\n5.158804 0.000681 0.001763\n-0.001896 5.512635 -0.044891\n-0.029833 -0.598221 7.549057\nLi Zr Nb Te O\n3 1 1 2 12\ndirect\n0.502072 0.050803 0.722863 Li\n0.002006 0.552648 0.729723 Li\n0.996547 0.590009 0.207298 Li\n0.000871 0.013079 0.009990 Zr\n0.501035 0.486951 0.488080 Nb\n0.502325 0.500250 0.996821 Te\n0.001376 0.992647 0.504561 Te\n0.365348 0.489270 0.247624 O\n0.189467 0.668270 0.945488 O\n0.116418 0.973250 0.268017 O\n0.688334 0.791640 0.063842 O\n0.334968 0.190362 0.935569 O\n0.690277 0.176082 0.451175 O\n0.869758 0.977892 0.740845 O\n0.300022 0.798656 0.576738 O\n0.626851 0.487152 0.752024 O\n0.819540 0.676199 0.443943 O\n0.806022 0.330332 0.072677 O\n0.186755 0.294913 0.572522 O\n",
"nsites": 19,
"nelements": 5,
"elements": [
"Li",
"Zr",
"Nb",
"Te",
"O"
],
"chemical_system": "Li-Nb-O-Te-Zr",
"density": 5.04745916912125,
"density_atomic": 0.08855893053591127,
"volume": 214.5464029999252,
"volume_molar": 6.800150728511766,
"formula_full": "Li3 Zr1 Nb1 Te2 O12",
"formula_reduced": "Li3ZrNb(TeO6)2",
"formula_anonymous": "ABC2D3E12",
"energy_above_hull": 2.719211128070175,
"spacegroup": 1
},
{
"id": "jvasp-97420",
"created_at": "2022-09-04T14:36:04.990987Z",
"updated_at": "2022-09-04T14:36:04.991004Z",
"structure_string": "As2 C2 S6 N4 F22\n1.0\n5.673704 -0.132580 -0.519699\n-1.878526 7.079632 -0.897658\n0.353097 -0.362402 12.491954\nAs C S N F\n2 2 6 4 22\ndirect\n0.514396 0.776121 0.817783 As\n0.485603 0.223879 0.182216 As\n0.045868 0.744981 0.271492 C\n0.954132 0.255019 0.728507 C\n0.180876 0.747369 0.409718 S\n0.819124 0.252631 0.590281 S\n0.834086 0.832129 0.121305 S\n0.917180 0.417730 0.839273 S\n0.165913 0.167871 0.878695 S\n0.082820 0.582270 0.160726 S\n0.922379 0.861665 0.250725 N\n0.060059 0.339688 0.927707 N\n0.077620 0.138335 0.749274 N\n0.939940 0.660312 0.072292 N\n0.701359 0.257028 0.472635 F\n0.187819 0.966065 0.447668 F\n0.652009 0.781995 0.696759 F\n0.534254 0.477120 0.200426 F\n0.452281 0.814422 0.370529 F\n0.616497 0.230868 0.056892 F\n0.298641 0.742972 0.527365 F\n0.820505 0.473493 0.628400 F\n0.547718 0.185578 0.629470 F\n0.777966 0.255026 0.249958 F\n0.222033 0.744974 0.750041 F\n0.347991 0.218004 0.303240 F\n0.432028 0.970558 0.161644 F\n0.806679 0.811159 0.892190 F\n0.909646 0.678019 0.446734 F\n0.179494 0.526507 0.371600 F\n0.465745 0.522880 0.799574 F\n0.567971 0.029442 0.838355 F\n0.383503 0.769132 0.943108 F\n0.193320 0.188840 0.107809 F\n0.812180 0.033935 0.552331 F\n0.090353 0.321981 0.553265 F\n",
"nsites": 36,
"nelements": 5,
"elements": [
"As",
"C",
"S",
"N",
"F"
],
"chemical_system": "As-C-F-N-S",
"density": 2.802833756832533,
"density_atomic": 0.07231762405795905,
"volume": 497.803965063174,
"volume_molar": 8.327348745823768,
"formula_full": "As2 C2 S6 N4 F22",
"formula_reduced": "AsCS3N2F11",
"formula_anonymous": "ABC2D3E11",
"energy_above_hull": 1.5143961865277773,
"spacegroup": 2
},
{
"id": "jvasp-26766",
"created_at": "2022-09-04T14:38:28.742849Z",
"updated_at": "2022-09-04T14:38:28.742876Z",
"structure_string": "Er12 Si4 Se8 O40 F4\n1.0\n5.853451 0.000000 0.000000\n0.000000 10.285168 0.000000\n0.000000 0.000000 15.393582\nEr Si Se O F\n12 4 8 40 4\ndirect\n0.928074 0.886561 0.652729 Er\n0.250000 0.125963 0.000000 Er\n0.571926 0.886561 0.347271 Er\n0.928074 0.613439 0.847271 Er\n0.750000 0.874037 0.000000 Er\n0.571926 0.613439 0.152729 Er\n0.071926 0.386561 0.152729 Er\n0.428074 0.113439 0.652729 Er\n0.750000 0.625963 0.500000 Er\n0.250000 0.374037 0.500000 Er\n0.071926 0.113439 0.347271 Er\n0.428074 0.386561 0.847271 Er\n0.750000 0.357346 0.000000 Si\n0.250000 0.857346 0.500000 Si\n0.750000 0.142654 0.500000 Si\n0.250000 0.642654 0.000000 Si\n0.035377 0.616302 0.324778 Se\n0.464623 0.883698 0.824778 Se\n0.535377 0.383698 0.324778 Se\n0.464623 0.616302 0.675222 Se\n0.964622 0.383698 0.675222 Se\n0.964622 0.116302 0.824778 Se\n0.035377 0.883698 0.175222 Se\n0.535377 0.116302 0.175222 Se\n0.321646 0.281199 0.361106 O\n0.769940 0.446669 0.911048 O\n0.269940 0.553331 0.911048 O\n0.321646 0.218801 0.138894 O\n0.521322 0.273607 0.972308 O\n0.178354 0.281199 0.638894 O\n0.479314 0.513500 0.586397 O\n0.021322 0.726393 0.972308 O\n0.821646 0.718801 0.361106 O\n0.678354 0.781199 0.861106 O\n0.520686 0.486500 0.413603 O\n0.269940 0.946669 0.588952 O\n0.120459 0.032984 0.745181 O\n0.678354 0.718801 0.638894 O\n0.020686 0.513500 0.413603 O\n0.978678 0.273607 0.027691 O\n0.620459 0.967016 0.745181 O\n0.521322 0.226393 0.527691 O\n0.620459 0.532984 0.754819 O\n0.379541 0.467016 0.245181 O\n0.978678 0.226393 0.472308 O\n0.230060 0.946669 0.411048 O\n0.479314 0.986500 0.913603 O\n0.979314 0.013500 0.913603 O\n0.230060 0.553331 0.088952 O\n0.021322 0.773607 0.527691 O\n0.379541 0.032984 0.254819 O\n0.730060 0.446669 0.088952 O\n0.020686 0.986500 0.086397 O\n0.120459 0.467016 0.754819 O\n0.478678 0.726393 0.027691 O\n0.730060 0.053331 0.411048 O\n0.478678 0.773607 0.472308 O\n0.879540 0.967016 0.254819 O\n0.520686 0.013500 0.086397 O\n0.821646 0.781199 0.138894 O\n0.979314 0.486500 0.586397 O\n0.178354 0.218801 0.861106 O\n0.879540 0.532984 0.245181 O\n0.769940 0.053331 0.588952 O\n0.436771 0.750000 0.250000 F\n0.936771 0.250000 0.250000 F\n0.563229 0.250000 0.750000 F\n0.063229 0.750000 0.750000 F\n",
"nsites": 68,
"nelements": 5,
"elements": [
"Er",
"Si",
"Se",
"O",
"F"
],
"chemical_system": "Er-F-O-Se-Si",
"density": 6.212299001091217,
"density_atomic": 0.07337461679428368,
"volume": 926.7510069680882,
"volume_molar": 8.207389725637599,
"formula_full": "Er12 Si4 Se8 O40 F4",
"formula_reduced": "Er3SiSe2O10F",
"formula_anonymous": "ABC2D3E10",
"energy_above_hull": 2.338732977401961,
"spacegroup": 52
},
{
"id": "jvasp-54566",
"created_at": "2022-09-04T14:38:12.617365Z",
"updated_at": "2022-09-04T14:38:12.617399Z",
"structure_string": "Na4 Sr8 Al4 P12\n1.0\n7.882514 -0.067511 1.909175\n2.714393 7.400719 1.909175\n0.040711 0.028173 11.534046\nNa Sr Al P\n4 8 4 12\ndirect\n0.695802 0.304198 0.000000 Na\n0.353024 0.353025 0.235480 Na\n0.646975 0.646975 0.764522 Na\n0.304197 0.695802 0.000000 Na\n0.192967 0.748208 0.685844 Sr\n0.807032 0.251792 0.314157 Sr\n0.748208 0.192967 0.685844 Sr\n-0.000000 0.500000 0.500000 Sr\n0.251791 0.807032 0.314157 Sr\n0.500000 0.000000 0.000000 Sr\n-0.000000 0.500000 0.000000 Sr\n0.500000 -0.000000 0.500000 Sr\n0.302975 0.302975 0.731379 Al\n0.909800 0.909802 0.117465 Al\n0.090199 0.090198 0.882537 Al\n0.697024 0.697025 0.268622 Al\n0.611314 0.021807 0.228450 P\n0.589457 0.589458 0.137541 P\n0.388685 0.978193 0.771551 P\n0.088691 0.088691 0.486536 P\n0.587495 0.587496 0.489728 P\n0.909302 0.909302 0.904615 P\n0.090697 0.090698 0.095386 P\n0.410542 0.410542 0.862461 P\n0.021806 0.611315 0.228450 P\n0.911308 0.911309 0.513465 P\n0.978193 0.388685 0.771551 P\n0.412504 0.412504 0.510273 P\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Na",
"Sr",
"Al",
"P"
],
"chemical_system": "Al-Na-P-Sr",
"density": 3.134638780661369,
"density_atomic": 0.04153634502404721,
"volume": 674.1084220046221,
"volume_molar": 14.498485017190415,
"formula_full": "Na4 Sr8 Al4 P12",
"formula_reduced": "NaSr2AlP3",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 1.2865158457142856,
"spacegroup": 12
},
{
"id": "jvasp-51075",
"created_at": "2022-09-04T14:38:33.607638Z",
"updated_at": "2022-09-04T14:38:33.607662Z",
"structure_string": "Ca4 Fe2 Cl2 O6\n1.0\n3.796300 -0.000000 0.000000\n-0.000000 3.796300 0.000000\n-0.000000 0.000000 13.829199\nCa Fe Cl O\n4 2 2 6\ndirect\n0.000000 0.000000 0.661204 Ca\n0.000000 0.000000 0.906736 Ca\n0.500000 0.500000 0.093273 Ca\n0.500000 0.500000 0.338795 Ca\n0.000000 0.000000 0.208485 Fe\n0.500000 0.500000 0.791520 Fe\n0.000000 0.000000 0.422946 Cl\n0.500000 0.500000 0.577031 Cl\n0.500000 0.000000 0.229663 O\n0.500000 0.500000 0.931219 O\n0.000000 0.000000 0.068784 O\n0.500000 0.000000 0.770333 O\n0.000000 0.500000 0.229663 O\n0.000000 0.500000 0.770333 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ca",
"Fe",
"Cl",
"O"
],
"chemical_system": "Ca-Cl-Fe-O",
"density": 3.6567978770209977,
"density_atomic": 0.07024411734186263,
"volume": 199.3049458058543,
"volume_molar": 8.573160270050186,
"formula_full": "Ca4 Fe2 Cl2 O6",
"formula_reduced": "Ca2FeClO3",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 1.260454415357143,
"spacegroup": 129
},
{
"id": "jvasp-51065",
"created_at": "2022-09-04T14:38:19.031267Z",
"updated_at": "2022-09-04T14:38:19.031276Z",
"structure_string": "Ti12 Al8 Ni4 O4\n1.0\n6.976149 0.000000 4.027682\n2.325384 6.577176 4.027682\n0.000000 0.000000 8.055362\nTi Al Ni O\n12 8 4 4\ndirect\n0.809299 0.440701 0.440701 Ti\n0.559299 0.559299 0.190701 Ti\n0.190701 0.190701 0.559299 Ti\n0.559299 0.190701 0.190701 Ti\n0.559299 0.190701 0.559298 Ti\n0.190701 0.559299 0.190701 Ti\n0.440701 0.809299 0.440701 Ti\n0.440701 0.440701 0.809298 Ti\n0.809298 0.809299 0.440701 Ti\n0.809299 0.440701 0.809298 Ti\n0.190701 0.559299 0.559299 Ti\n0.440701 0.809299 0.809298 Ti\n0.791776 0.791777 0.791776 Al\n0.208224 0.208224 0.875328 Al\n0.208223 0.875329 0.208223 Al\n0.875328 0.208224 0.208223 Al\n0.791776 0.791777 0.124671 Al\n0.124671 0.791777 0.791776 Al\n0.208224 0.208224 0.208223 Al\n0.791776 0.124672 0.791776 Al\n0.500000 -0.000000 -0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n-0.000000 -0.000000 0.500000 Ni\n-0.000000 0.500000 -0.000000 Ni\n0.500000 0.500000 0.500000 O\n0.500000 0.500000 -0.000000 O\n-0.000000 0.500000 0.500000 O\n0.500000 -0.000000 0.500000 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ti",
"Al",
"Ni",
"O"
],
"chemical_system": "Al-Ni-O-Ti",
"density": 4.8926897135190615,
"density_atomic": 0.0757561260678366,
"volume": 369.60707276566797,
"volume_molar": 7.949377921737198,
"formula_full": "Ti12 Al8 Ni4 O4",
"formula_reduced": "Ti3Al2NiO",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 2.8090409285714286,
"spacegroup": 227
},
{
"id": "jvasp-108774",
"created_at": "2022-09-04T14:38:20.052200Z",
"updated_at": "2022-09-04T14:38:20.052226Z",
"structure_string": "K2 Pd1 Br3 Cl1\n1.0\n7.281064 -0.206641 0.000000\n-0.240116 7.280037 0.000000\n-0.000000 -0.000000 4.188056\nK Pd Br Cl\n2 1 3 1\ndirect\n0.510028 0.012489 0.500001 K\n0.987511 0.489972 0.500001 K\n0.998407 0.001593 -0.000000 Pd\n0.230182 0.769818 -0.000000 Br\n0.247838 0.249992 -0.000000 Br\n0.750007 0.752162 -0.000000 Br\n0.776024 0.223975 -0.000000 Cl\n",
"nsites": 7,
"nelements": 4,
"elements": [
"K",
"Pd",
"Br",
"Cl"
],
"chemical_system": "Br-Cl-K-Pd",
"density": 3.4424408818205903,
"density_atomic": 0.03156195134565277,
"volume": 221.78603354840274,
"volume_molar": 19.080381609008054,
"formula_full": "K2 Pd1 Br3 Cl1",
"formula_reduced": "K2PdBr3Cl",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-109697",
"created_at": "2022-09-04T14:38:19.179979Z",
"updated_at": "2022-09-04T14:38:19.179990Z",
"structure_string": "Ni3 Pb2 Se1 S1\n1.0\n4.922214 -0.018766 2.886063\n1.644434 4.639438 2.886063\n-0.026670 -0.018766 5.705860\nNi Pb Se S\n3 2 1 1\ndirect\n0.993773 0.993774 0.503605 Ni\n0.503604 0.993774 0.993775 Ni\n0.993774 0.503604 0.993775 Ni\n0.000126 0.000126 0.000126 Pb\n0.504396 0.504396 0.504397 Pb\n0.278430 0.278430 0.278430 Se\n0.725891 0.725891 0.725892 S\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Ni",
"Pb",
"Se",
"S"
],
"chemical_system": "Ni-Pb-S-Se",
"density": 8.891312280577345,
"density_atomic": 0.05342984468152212,
"volume": 131.01292062001522,
"volume_molar": 11.271117847891974,
"formula_full": "Ni3 Pb2 Se1 S1",
"formula_reduced": "Ni3Pb2SeS",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 1.076854600952381,
"spacegroup": 160
},
{
"id": "jvasp-85785",
"created_at": "2022-09-04T14:35:45.949475Z",
"updated_at": "2022-09-04T14:35:45.949499Z",
"structure_string": "K2 H4 I6 O2\n1.0\n4.110159 0.000000 -2.014820\n0.000000 9.992311 0.000000\n-0.014324 0.000000 9.396564\nK H I O\n2 4 6 2\ndirect\n0.023964 0.239149 0.616382 K\n0.023964 0.760851 0.116382 K\n0.738406 0.194063 0.874451 H\n0.738405 0.805937 0.374451 H\n0.707679 0.348730 0.846678 H\n0.707679 0.651270 0.346678 H\n0.342777 0.536402 0.909903 I\n0.342777 0.463598 0.409904 I\n0.376453 0.754507 0.699679 I\n0.376452 0.245493 0.199679 I\n0.394099 0.974621 0.489801 I\n0.394099 0.025379 0.989801 I\n0.689827 0.262819 0.792304 O\n0.689826 0.737181 0.292304 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"H",
"I",
"O"
],
"chemical_system": "H-I-K-O",
"density": 3.770618857189057,
"density_atomic": 0.03630438192653444,
"volume": 385.6283802966376,
"volume_molar": 16.587917051408297,
"formula_full": "K2 H4 I6 O2",
"formula_reduced": "KH2I3O",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 0.7970043321428577,
"spacegroup": 7
}
]
}