{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=561","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=559","results":[{"id":"jvasp-97957","created_at":"2022-09-04T14:35:51.504171Z","updated_at":"2022-09-04T14:35:51.504191Z","structure_string":"H48 C12 S12 N24\n1.0\n5.572585 -0.000000 0.000000\n-0.000000 7.115518 0.000000\n0.000000 0.000000 25.031811\nH C S N\n48 12 12 24\ndirect\n0.945675 0.518942 0.204158 H\n0.284048 0.402316 0.506164 H\n0.215951 0.902317 0.993836 H\n0.284048 0.402316 0.993836 H\n0.215951 0.902317 0.506164 H\n0.715951 0.597684 0.493836 H\n0.784048 0.097684 0.006164 H\n0.853982 0.785532 0.133094 H\n0.646017 0.285531 0.366906 H\n0.146018 0.214469 0.633094 H\n0.353982 0.714469 0.866906 H\n0.146018 0.214469 0.866906 H\n0.353982 0.714469 0.633094 H\n0.853982 0.785532 0.366906 H\n0.646017 0.285531 0.133094 H\n0.609433 0.680415 0.165939 H\n0.890566 0.180415 0.334061 H\n0.390566 0.319585 0.665939 H\n0.109433 0.819585 0.834061 H\n0.390566 0.319585 0.834061 H\n0.109433 0.819585 0.665939 H\n0.609433 0.680415 0.334061 H\n0.784048 0.097684 0.493836 H\n0.715951 0.597684 0.006164 H\n0.890566 0.180415 0.165939 H\n0.918050 0.733414 0.455148 H\n0.581949 0.233414 0.044852 H\n0.554323 0.018941 0.295842 H\n0.445676 0.981059 0.795842 H\n0.054324 0.481059 0.795842 H\n0.445676 0.981059 0.704158 H\n0.945675 0.518942 0.295842 H\n0.554323 0.018941 0.204158 H\n0.214341 0.497944 0.168075 H\n0.285659 0.997944 0.331925 H\n0.785658 0.502056 0.668075 H\n0.054324 0.481059 0.704158 H\n0.785658 0.502056 0.831925 H\n0.714341 0.002056 0.831925 H\n0.081950 0.266586 0.955148 H\n0.418050 0.766586 0.955148 H\n0.081950 0.266586 0.544852 H\n0.418050 0.766586 0.544852 H\n0.918050 0.733414 0.044852 H\n0.285659 0.997944 0.168075 H\n0.214341 0.497944 0.331925 H\n0.714341 0.002056 0.668075 H\n0.581949 0.233414 0.455148 H\n0.124698 0.867004 0.914882 C\n0.875301 0.132996 0.085118 C\n0.624698 0.632996 0.414882 C\n0.124698 0.867004 0.585118 C\n0.375301 0.367004 0.914882 C\n0.375301 0.367004 0.585118 C\n0.749653 0.008017 0.750000 C\n0.624698 0.632996 0.085118 C\n0.750345 0.508017 0.750000 C\n0.250346 0.991983 0.250000 C\n0.249654 0.491983 0.250000 C\n0.875301 0.132996 0.414882 C\n0.135037 0.003145 0.082276 S\n0.864962 0.996855 0.917724 S\n0.364962 0.503146 0.417724 S\n0.864962 0.996855 0.582276 S\n0.635037 0.496855 0.917724 S\n0.635037 0.496855 0.582276 S\n0.556219 0.470963 0.250000 S\n0.364962 0.503146 0.082276 S\n0.056219 0.029037 0.750000 S\n0.443780 0.529037 0.750000 S\n0.943780 0.970963 0.250000 S\n0.135037 0.003145 0.417724 S\n0.196010 0.787537 0.631190 N\n0.303989 0.287536 0.868810 N\n0.196010 0.787537 0.868810 N\n0.303989 0.287536 0.631190 N\n0.803989 0.212464 0.368810 N\n0.696010 0.712464 0.131190 N\n0.737253 0.157040 0.041964 N\n0.762746 0.657040 0.458036 N\n0.262746 0.842960 0.541964 N\n0.237253 0.342960 0.958036 N\n0.262746 0.842960 0.958036 N\n0.737253 0.157040 0.458036 N\n0.762746 0.657040 0.041964 N\n0.373383 0.998387 0.204108 N\n0.126616 0.498387 0.295891 N\n0.626616 0.001613 0.704108 N\n0.873383 0.501614 0.795891 N\n0.626616 0.001613 0.795891 N\n0.873383 0.501614 0.704108 N\n0.373383 0.998387 0.295891 N\n0.126616 0.498387 0.204108 N\n0.696010 0.712464 0.368810 N\n0.237253 0.342960 0.541964 N\n0.803989 0.212464 0.131190 N\n","nsites":96,"nelements":4,"elements":["H","C","S","N"],"chemical_system":"C-H-N-S","density":1.5281941591867592,"density_atomic":0.09671987771460144,"volume":992.5570861790619,"volume_molar":6.226373422193502,"formula_full":"H48 C12 S12 N24","formula_reduced":"H4CSN2","formula_anonymous":"ABC2D4","energy_above_hull":4.1276195625,"spacegroup":62},{"id":"jvasp-91729","created_at":"2022-09-04T14:36:02.924929Z","updated_at":"2022-09-04T14:36:02.924963Z","structure_string":"Ce2 Mn2 As2 O2\n1.0\n3.926835 -0.000000 -0.000000\n-0.000000 3.926835 0.000000\n-0.000000 0.000000 8.316243\nCe Mn As O\n2 2 2 2\ndirect\n0.750001 0.750001 0.848893 Ce\n0.250000 0.250000 0.151107 Ce\n0.750001 0.250000 0.500000 Mn\n0.250000 0.750001 0.500000 Mn\n0.750001 0.750001 0.341109 As\n0.250000 0.250000 0.658891 As\n0.750001 0.250000 0.000000 O\n0.250000 0.750001 0.000000 O\n","nsites":8,"nelements":4,"elements":["Ce","Mn","As","O"],"chemical_system":"As-Ce-Mn-O","density":7.406188353591217,"density_atomic":0.062384616498005474,"volume":128.2367424708906,"volume_molar":9.653246422044667,"formula_full":"Ce2 Mn2 As2 O2","formula_reduced":"CeMnAsO","formula_anonymous":"ABCD","energy_above_hull":2.322401997844828,"spacegroup":129},{"id":"jvasp-87192","created_at":"2022-09-04T14:35:58.010386Z","updated_at":"2022-09-04T14:35:58.010411Z","structure_string":"K8 Li12 Fe4 O16\n1.0\n5.485862 0.000000 -0.828053\n0.000000 8.740557 0.000000\n-0.002628 0.000000 10.359542\nK Li Fe O\n8 12 4 16\ndirect\n0.843213 0.992764 0.138484 K\n0.156786 0.007237 0.861516 K\n0.343213 0.507237 0.638484 K\n0.611867 0.773903 0.891995 K\n0.888132 0.273903 0.608005 K\n0.388132 0.226097 0.108005 K\n0.111868 0.726097 0.391995 K\n0.656786 0.492763 0.361516 K\n0.421343 0.261969 0.800211 Li\n0.801415 0.006205 0.429488 Li\n0.921343 0.238031 0.300211 Li\n0.605887 0.032143 0.702480 Li\n0.894112 0.532144 0.797520 Li\n0.394112 0.967857 0.297520 Li\n0.105888 0.467857 0.202480 Li\n0.301415 0.493795 0.929488 Li\n0.198584 0.993795 0.570512 Li\n0.698584 0.506206 0.070512 Li\n0.578656 0.738031 0.199789 Li\n0.078656 0.761969 0.699789 Li\n0.662667 0.786818 0.562923 Fe\n0.837332 0.286818 0.937077 Fe\n0.337332 0.213182 0.437077 Fe\n0.162667 0.713183 0.062923 Fe\n0.163647 0.395469 0.384557 O\n0.113848 0.324764 0.854785 O\n0.386151 0.824764 0.645215 O\n0.886151 0.675237 0.145215 O\n0.613848 0.175236 0.354785 O\n0.386661 0.189702 0.621505 O\n0.113338 0.689702 0.878494 O\n0.613338 0.810299 0.378495 O\n0.663647 0.104531 0.884557 O\n0.836352 0.604531 0.615443 O\n0.619448 0.451443 0.877511 O\n0.880551 0.951444 0.622489 O\n0.380551 0.548557 0.122489 O\n0.119449 0.048557 0.377511 O\n0.336352 0.895469 0.115443 O\n0.886661 0.310299 0.121506 O\n","nsites":40,"nelements":4,"elements":["K","Li","Fe","O"],"chemical_system":"Fe-K-Li-O","density":2.92665773553602,"density_atomic":0.0805289576995548,"volume":496.7157298773921,"volume_molar":7.478230107569483,"formula_full":"K8 Li12 Fe4 O16","formula_reduced":"K2Li3FeO4","formula_anonymous":"AB2C3D4","energy_above_hull":1.4110985499999995,"spacegroup":14},{"id":"jvasp-48339","created_at":"2022-09-04T14:35:53.455137Z","updated_at":"2022-09-04T14:35:53.455163Z","structure_string":"Li3 Co2 Ge2 O8\n1.0\n5.062238 -0.000327 -0.031762\n0.011711 5.436881 0.010284\n0.037128 0.038009 6.436293\nLi Co Ge O\n3 2 2 8\ndirect\n0.498967 0.168383 0.003070 Li\n0.001926 0.335750 0.253002 Li\n0.000084 0.830796 0.505664 Li\n0.993085 0.833776 0.991761 Co\n0.502722 0.161488 0.502401 Co\n0.994224 0.332096 0.754286 Ge\n0.497111 0.672645 0.253289 Ge\n0.646236 0.284634 0.750110 O\n0.615367 0.833735 0.474287 O\n0.606676 0.358021 0.260572 O\n0.622097 0.834155 0.033899 O\n0.141459 0.681720 0.244528 O\n0.110260 0.175886 0.986528 O\n0.080297 0.647528 0.756103 O\n0.119217 0.185559 0.523261 O\n","nsites":15,"nelements":4,"elements":["Li","Co","Ge","O"],"chemical_system":"Co-Ge-Li-O","density":3.861623241243272,"density_atomic":0.08467440877221123,"volume":177.14915542371944,"volume_molar":7.11211432984504,"formula_full":"Li3 Co2 Ge2 O8","formula_reduced":"Li3Co2(GeO4)2","formula_anonymous":"A2B2C3D8","energy_above_hull":2.33510478,"spacegroup":1},{"id":"jvasp-48242","created_at":"2022-09-04T14:35:53.461146Z","updated_at":"2022-09-04T14:35:53.461167Z","structure_string":"Li3 Ti2 Ni2 O8\n1.0\n5.850250 0.008075 0.004547\n-0.008048 5.816963 -0.008610\n-2.896699 -2.906344 4.211739\nLi Ti Ni O\n3 2 2 8\ndirect\n-0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n-0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Ti\n0.500000 0.000001 0.000000 Ti\n0.500000 0.000001 0.500000 Ni\n0.500000 0.500001 0.500000 Ni\n0.750872 0.763014 0.525821 O\n0.709986 0.233639 0.467408 O\n0.249850 0.224592 0.993500 O\n0.249755 0.768842 0.993331 O\n0.750245 0.231159 0.006670 O\n0.750150 0.775410 0.006501 O\n0.290014 0.766362 0.532593 O\n0.249128 0.236987 0.474180 O\n","nsites":15,"nelements":4,"elements":["Li","Ti","Ni","O"],"chemical_system":"Li-Ni-O-Ti","density":4.1952903393436225,"density_atomic":0.10470533278256713,"volume":143.25917889157807,"volume_molar":5.751512936314026,"formula_full":"Li3 Ti2 Ni2 O8","formula_reduced":"Li3Ti2(NiO4)2","formula_anonymous":"A2B2C3D8","energy_above_hull":2.427816631111111,"spacegroup":12},{"id":"jvasp-85481","created_at":"2022-09-04T14:35:58.055722Z","updated_at":"2022-09-04T14:35:58.055738Z","structure_string":"Ca2 Fe1 W1 O6\n1.0\n4.675528 -0.001231 2.700595\n1.573733 4.398941 2.676541\n-0.005478 -0.034439 5.408853\nCa Fe W O\n2 1 1 6\ndirect\n0.247517 0.240251 0.264599 Ca\n0.752494 0.759747 0.735401 Ca\n0.500000 0.499999 0.500001 Fe\n0.000001 0.000003 0.000000 W\n0.249544 0.666584 0.834191 O\n0.206286 0.795215 0.293848 O\n0.793713 0.204788 0.706149 O\n0.295066 0.205077 0.705727 O\n0.750446 0.333414 0.165808 O\n0.704932 0.794918 0.294278 O\n","nsites":10,"nelements":4,"elements":["Ca","Fe","W","O"],"chemical_system":"Ca-Fe-O-W","density":6.18706679354774,"density_atomic":0.08960085633264926,"volume":111.60607620617287,"volume_molar":6.721075005848599,"formula_full":"Ca2 Fe1 W1 O6","formula_reduced":"Ca2FeWO6","formula_anonymous":"ABC2D6","energy_above_hull":2.728883734,"spacegroup":12},{"id":"jvasp-89914","created_at":"2022-09-04T14:35:49.456322Z","updated_at":"2022-09-04T14:35:49.456347Z","structure_string":"Cu1 Pb2 Cl2 O4\n1.0\n0.000000 0.000000 5.586334\n5.550532 0.000000 0.000000\n0.000000 5.550532 0.000000\nCu Pb Cl O\n1 2 2 4\ndirect\n0.306274 0.000000 0.000000 Cu\n0.062669 0.000000 0.500000 Pb\n0.062669 0.500000 0.000000 Pb\n0.762278 0.000000 0.000000 Cl\n0.798476 0.500000 0.500000 Cl\n0.262658 0.232426 0.767574 O\n0.262658 0.767574 0.232426 O\n0.262658 0.767574 0.767574 O\n0.262658 0.232426 0.232426 O\n","nsites":9,"nelements":4,"elements":["Cu","Pb","Cl","O"],"chemical_system":"Cl-Cu-O-Pb","density":5.912986463465789,"density_atomic":0.05229334101963044,"volume":172.10604303560336,"volume_molar":11.516075742300234,"formula_full":"Cu1 Pb2 Cl2 O4","formula_reduced":"CuPb2(ClO2)2","formula_anonymous":"AB2C2D4","energy_above_hull":1.2342860250000005,"spacegroup":99},{"id":"jvasp-98439","created_at":"2022-09-04T14:35:47.797256Z","updated_at":"2022-09-04T14:35:47.797288Z","structure_string":"Cd4 H16 S8 O20\n1.0\n5.517400 0.000000 -1.127211\n0.000000 7.148273 0.000000\n-0.074108 0.000000 14.134374\nCd H S O\n4 16 8 20\ndirect\n0.445463 0.169406 0.818086 Cd\n0.945463 0.330593 0.318086 Cd\n0.554536 0.830593 0.181914 Cd\n0.054536 0.669406 0.681913 Cd\n0.465338 0.635311 0.582634 H\n0.965338 0.864689 0.082634 H\n0.534661 0.364689 0.417366 H\n0.034661 0.135311 0.917366 H\n0.700920 0.858879 0.536468 H\n0.200920 0.641121 0.036469 H\n0.299079 0.141121 0.463531 H\n0.799079 0.358879 0.963531 H\n0.221968 0.624853 0.505090 H\n0.721968 0.875147 0.005090 H\n0.778031 0.375147 0.494910 H\n0.278031 0.124853 0.994909 H\n0.728974 0.661671 0.483398 H\n0.228973 0.838328 0.983398 H\n0.271026 0.338328 0.516602 H\n0.771026 0.161671 0.016602 H\n0.855498 0.177508 0.658987 S\n0.355499 0.322492 0.158987 S\n0.144501 0.822491 0.341013 S\n0.644501 0.677508 0.841013 S\n0.177722 0.026605 0.664562 S\n0.677723 0.473394 0.164562 S\n0.822277 0.973394 0.335438 S\n0.322277 0.526605 0.835438 S\n0.702390 0.415482 0.428193 O\n0.202390 0.084518 0.928193 O\n0.738806 0.724372 0.546258 O\n0.238806 0.775628 0.046258 O\n0.261193 0.275628 0.453742 O\n0.761193 0.224372 0.953742 O\n0.903690 0.363824 0.619588 O\n0.403690 0.136176 0.119588 O\n0.096310 0.636176 0.380412 O\n0.596310 0.863823 0.880411 O\n0.810108 0.195777 0.757854 O\n0.310108 0.304223 0.257854 O\n0.189892 0.804223 0.242146 O\n0.689892 0.695777 0.742146 O\n0.664384 0.079331 0.591559 O\n0.164385 0.420669 0.091559 O\n0.335615 0.920669 0.408440 O\n0.835615 0.579330 0.908440 O\n0.797610 0.915482 0.071807 O\n0.297610 0.584518 0.571806 O\n","nsites":48,"nelements":4,"elements":["Cd","H","S","O"],"chemical_system":"Cd-H-O-S","density":3.108038398434086,"density_atomic":0.08619746848286572,"volume":556.8609014259092,"volume_molar":6.986447358598563,"formula_full":"Cd4 H16 S8 O20","formula_reduced":"CdH4S2O5","formula_anonymous":"AB2C4D5","energy_above_hull":2.377052270833333,"spacegroup":14},{"id":"jvasp-96551","created_at":"2022-09-04T14:35:47.800426Z","updated_at":"2022-09-04T14:35:47.800454Z","structure_string":"Sm6 Cu2 Sn2 Se14\n1.0\n10.418123 0.000001 -0.000000\n-5.209062 9.022358 -0.000000\n0.000000 -0.000000 6.406027\nSm Cu Sn Se\n6 2 2 14\ndirect\n0.211397 0.357292 0.937770 Sm\n0.145894 0.788603 0.937770 Sm\n0.642708 0.854107 0.937770 Sm\n0.788603 0.642708 0.437770 Sm\n0.357292 0.145893 0.437770 Sm\n0.854106 0.211397 0.437770 Sm\n0.000000 0.000000 0.013730 Cu\n0.000000 0.000000 0.513730 Cu\n0.333333 0.666667 0.364217 Sn\n0.666667 0.333333 0.864217 Sn\n0.666667 0.333333 0.259507 Se\n0.079402 0.516241 0.186885 Se\n0.483759 0.563160 0.186885 Se\n0.262587 0.110757 0.991961 Se\n0.333333 0.666667 0.759507 Se\n0.110758 0.848169 0.491961 Se\n0.436840 0.920598 0.186885 Se\n0.889242 0.151831 0.991961 Se\n0.516241 0.436840 0.686886 Se\n0.920598 0.483759 0.686886 Se\n0.151831 0.262587 0.491961 Se\n0.737413 0.889243 0.491961 Se\n0.563160 0.079402 0.686886 Se\n0.848169 0.737413 0.991961 Se\n","nsites":24,"nelements":4,"elements":["Sm","Cu","Sn","Se"],"chemical_system":"Cu-Se-Sm-Sn","density":6.541629797887502,"density_atomic":0.03985776265839336,"volume":602.1411739965292,"volume_molar":15.109078779994796,"formula_full":"Sm6 Cu2 Sn2 Se14","formula_reduced":"Sm3CuSnSe7","formula_anonymous":"ABC3D7","energy_above_hull":1.3428851951388887,"spacegroup":173},{"id":"jvasp-87166","created_at":"2022-09-04T14:36:00.800669Z","updated_at":"2022-09-04T14:36:00.800693Z","structure_string":"Sr2 Ca1 W1 O6\n1.0\n5.089674 0.000000 2.938525\n1.696558 4.798591 2.938525\n-0.000000 -0.000000 5.877049\nSr Ca W O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750001 Sr\n0.500000 0.500000 0.500001 Ca\n0.000000 0.000000 0.000000 W\n0.232188 0.767812 0.767813 O\n0.232188 0.767812 0.232189 O\n0.767812 0.232188 0.767813 O\n0.232188 0.232188 0.767813 O\n0.767812 0.232188 0.232189 O\n0.767812 0.767812 0.232189 O\n","nsites":10,"nelements":4,"elements":["Sr","Ca","W","O"],"chemical_system":"Ca-O-Sr-W","density":5.728312827997129,"density_atomic":0.06966858454541393,"volume":143.53671838246453,"volume_molar":8.643983223276809,"formula_full":"Sr2 Ca1 W1 O6","formula_reduced":"Sr2CaWO6","formula_anonymous":"ABC2D6","energy_above_hull":2.191906404,"spacegroup":225},{"id":"jvasp-97783","created_at":"2022-09-04T14:35:54.991759Z","updated_at":"2022-09-04T14:35:54.991787Z","structure_string":"Ca1 Ti4 P6 O24\n1.0\n7.387601 0.008385 4.844436\n2.620675 6.907155 4.844436\n0.012135 0.008385 8.834312\nCa Ti P O\n1 4 6 24\ndirect\n0.000000 0.000000 0.000000 Ca\n0.357872 0.357872 0.357873 Ti\n0.147270 0.147270 0.147271 Ti\n0.852729 0.852729 0.852731 Ti\n0.642127 0.642127 0.642129 Ti\n0.539593 0.970551 0.246789 P\n0.246786 0.539594 0.970553 P\n0.970552 0.246787 0.539595 P\n0.460406 0.029448 0.753213 P\n0.029447 0.753212 0.460407 P\n0.753212 0.460405 0.029449 P\n0.838153 0.769209 0.479141 O\n0.256566 0.103146 0.898233 O\n0.520860 0.161846 0.230791 O\n0.161845 0.230790 0.520861 O\n0.230790 0.520860 0.161847 O\n0.479139 0.838154 0.769211 O\n0.548683 0.479493 0.183819 O\n0.808291 0.617094 0.997379 O\n0.479493 0.183818 0.548684 O\n0.183818 0.548683 0.479494 O\n0.451316 0.520507 0.816183 O\n0.520506 0.816181 0.451318 O\n0.816181 0.451316 0.520508 O\n0.896854 0.101767 0.743434 O\n0.997377 0.808291 0.617096 O\n0.101766 0.743433 0.896855 O\n0.103145 0.898232 0.256568 O\n0.898232 0.256566 0.103146 O\n0.382906 0.002622 0.191708 O\n0.191708 0.382906 0.002623 O\n0.002622 0.191708 0.382906 O\n0.617093 0.997377 0.808294 O\n0.743433 0.896854 0.101769 O\n0.769209 0.479139 0.838155 O\n","nsites":35,"nelements":4,"elements":["Ca","Ti","P","O"],"chemical_system":"Ca-O-P-Ti","density":2.957154649216148,"density_atomic":0.07777815608821236,"volume":449.99781121456044,"volume_molar":7.742714745217113,"formula_full":"Ca1 Ti4 P6 O24","formula_reduced":"CaTi4(PO4)6","formula_anonymous":"AB4C6D24","energy_above_hull":3.2677805929523807,"spacegroup":148},{"id":"jvasp-105679","created_at":"2022-09-04T14:36:03.103722Z","updated_at":"2022-09-04T14:36:03.103746Z","structure_string":"Rb2 In1 Sb1 Br6\n1.0\n7.093599 0.000000 4.095491\n2.364533 6.687910 4.095491\n0.000000 0.000000 8.190984\nRb In Sb Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Sb\n0.757258 0.242742 0.242742 Br\n0.242742 0.242742 0.757257 Br\n0.242742 0.757258 0.757257 Br\n0.242742 0.757258 0.242742 Br\n0.757258 0.242742 0.757257 Br\n0.757258 0.757258 0.242742 Br\n","nsites":10,"nelements":4,"elements":["Rb","In","Sb","Br"],"chemical_system":"Br-In-Rb-Sb","density":3.790085714783425,"density_atomic":0.02573397460517925,"volume":388.5913526155182,"volume_molar":23.40151823569445,"formula_full":"Rb2 In1 Sb1 Br6","formula_reduced":"Rb2InSbBr6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225}]}