{"count":55712,"next":null,"previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=4642","results":[{"id":"jvasp-106846","created_at":"2022-09-04T14:36:45.906602Z","updated_at":"2022-09-04T14:36:45.906622Z","structure_string":"Ba1 Ga2 Si1 S6\n1.0\n5.993393 0.022882 -1.400718\n-1.176347 6.048658 -1.052870\n-0.049526 0.041928 6.385950\nBa Ga Si S\n1 2 1 6\ndirect\n0.469521 0.457671 0.443441 Ba\n0.998026 0.845686 0.265994 Ga\n0.263455 0.984416 0.858410 Ga\n0.844882 0.274512 0.995552 Si\n0.036739 0.711036 0.581899 S\n0.591320 0.049761 0.734940 S\n0.711954 0.575882 0.017470 S\n0.896590 0.190434 0.313701 S\n0.345240 0.899780 0.198530 S\n0.158311 0.326867 0.906104 S\n","nsites":10,"nelements":4,"elements":["Ba","Ga","Si","S"],"chemical_system":"Ba-Ga-S-Si","density":3.565347269243741,"density_atomic":0.04317966393279689,"volume":231.59050092570433,"volume_molar":13.946705952535018,"formula_full":"Ba1 Ga2 Si1 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C\n0.622302 0.517224 0.628692 C\n0.681288 0.347394 0.452908 C\n0.545922 0.286809 0.775691 C\n0.568700 0.330816 0.553433 C\n0.443688 0.238329 0.874374 C\n0.527164 0.483508 0.737555 C\n0.004325 0.033945 0.041589 S\n0.904308 0.314160 0.231871 S\n","nsites":29,"nelements":3,"elements":["H","C","S"],"chemical_system":"C-H-S","density":1.5476435256184269,"density_atomic":0.09708769191534808,"volume":298.69903617943095,"volume_molar":6.202784968099538,"formula_full":"H10 C17 S2","formula_reduced":"H10C17S2","formula_anonymous":"A2B10C17","energy_above_hull":5.854763448275862,"spacegroup":1},{"id":"jvasp-48611","created_at":"2022-09-04T14:36:46.343945Z","updated_at":"2022-09-04T14:36:46.343955Z","structure_string":"Li7 Mn1 O3 F3\n1.0\n5.278955 0.053137 -0.056603\n2.523964 5.006111 -0.064503\n2.111085 1.756440 5.051490\nLi Mn O F\n7 1 3 3\ndirect\n0.552801 0.853576 0.365867 Li\n0.115091 0.778806 0.651349 Li\n0.620591 0.697042 0.004753 Li\n0.397080 0.250688 0.997694 Li\n0.876980 0.223912 0.397628 Li\n0.217390 0.547855 0.333220 Li\n0.479971 0.114134 0.620863 Li\n0.945719 0.076110 0.002412 Mn\n0.229658 0.920999 0.239831 O\n0.768785 0.040624 0.775637 O\n0.571595 0.252582 0.246295 O\n0.442107 0.762605 0.727259 F\n0.892408 0.578521 0.249207 F\n0.154547 0.410079 0.726758 F\n","nsites":14,"nelements":4,"elements":["Li","Mn","O","F"],"chemical_system":"F-Li-Mn-O","density":2.5886813819694763,"density_atomic":0.10466778674542522,"volume":133.75653040272113,"volume_molar":5.7535760975314725,"formula_full":"Li7 Mn1 O3 F3","formula_reduced":"Li7Mn(OF)3","formula_anonymous":"AB3C3D7","energy_above_hull":1.2353734706342363,"spacegroup":1},{"id":"jvasp-104110","created_at":"2022-09-04T14:36:46.442596Z","updated_at":"2022-09-04T14:36:46.442617Z","structure_string":"H6 C14 N2 O2\n1.0\n3.642955 0.068546 0.081845\n0.096018 5.639069 0.798323\n-0.055332 0.240980 11.019288\nH C N O\n6 14 2 2\ndirect\n0.343311 0.730027 0.226626 H\n0.856067 0.024609 0.031273 H\n0.384192 0.467461 0.651979 H\n0.181798 0.664534 0.447296 H\n0.821690 0.282919 0.602761 H\n0.024199 0.083227 0.809385 H\n0.055698 0.992687 0.729925 C\n0.942950 0.103751 0.615474 C\n0.985877 0.988659 0.511955 C\n0.147504 0.758250 0.525559 C\n0.261294 0.646207 0.641141 C\n0.215996 0.760794 0.744232 C\n0.856541 0.118885 0.395933 C\n0.757902 0.186196 0.197227 C\n0.742517 0.173269 0.072586 C\n0.570877 0.376448 0.007906 C\n0.430751 0.573755 0.059948 C\n0.451734 0.580547 0.185398 C\n0.621028 0.379175 0.253461 C\n0.328253 0.651130 0.866256 C\n0.280369 0.741615 0.967097 N\n0.689298 0.328237 0.378580 N\n0.504677 0.425923 0.882746 O\n0.909474 0.017735 0.289258 O\n","nsites":24,"nelements":4,"elements":["H","C","N","O"],"chemical_system":"C-H-N-O","density":1.7237663131607142,"density_atomic":0.10637406773303541,"volume":225.61889858562387,"volume_molar":5.661286522494966,"formula_full":"H6 C14 N2 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O\n","nsites":15,"nelements":4,"elements":["Li","Co","Si","O"],"chemical_system":"Co-Li-O-Si","density":3.212108389707184,"density_atomic":0.08987192477855993,"volume":166.90418099934183,"volume_molar":6.700803142737026,"formula_full":"Li3 Co2 Si2 O8","formula_reduced":"Li3Co2(SiO4)2","formula_anonymous":"A2B2C3D8","energy_above_hull":2.690202466666667,"spacegroup":1},{"id":"jvasp-101877","created_at":"2022-09-04T14:36:46.717235Z","updated_at":"2022-09-04T14:36:46.717243Z","structure_string":"Sn1 H12 C7 O4\n1.0\n5.157872 0.017882 0.081255\n-0.744614 6.207067 -0.378830\n0.106525 0.295824 7.022876\nSn H C O\n1 12 7 4\ndirect\n-0.002488 0.667457 0.638762 Sn\n0.996057 0.273634 0.483713 H\n0.143884 0.469705 0.318458 H\n0.080028 0.892031 0.963178 H\n0.767248 0.920780 0.868400 H\n0.055710 0.076451 0.772165 H\n0.327234 0.390856 0.517517 H\n0.347555 0.327153 0.029327 H\n0.623238 0.280836 0.297879 H\n0.835498 0.136507 0.157981 H\n0.488653 0.827522 0.124128 H\n0.263887 0.968309 0.261930 H\n0.465291 0.117066 0.899688 H\n0.471326 0.948216 0.238995 C\n0.630104 0.161887 0.181141 C\n0.525339 0.248838 0.000888 C\n0.717193 0.400653 0.888611 C\n0.136046 0.417814 0.466784 C\n0.975962 0.924537 0.835985 C\n0.571434 0.863438 0.419735 C\n0.435629 0.859684 0.571928 O\n0.629928 0.480670 0.737268 O\n0.954292 0.445538 0.930743 O\n0.803346 0.801312 0.405653 O\n","nsites":24,"nelements":4,"elements":["Sn","H","C","O"],"chemical_system":"C-H-O-Sn","density":2.054164265816732,"density_atomic":0.10645924984502145,"volume":225.4383722874068,"volume_molar":5.656756710916863,"formula_full":"Sn1 H12 C7 O4","formula_reduced":"SnH12C7O4","formula_anonymous":"AB4C7D12","energy_above_hull":4.401464404166667,"spacegroup":1},{"id":"jvasp-103931","created_at":"2022-09-04T14:36:46.726764Z","updated_at":"2022-09-04T14:36:46.726784Z","structure_string":"Zn1 H18 C11 O4\n1.0\n3.954035 0.231494 0.187763\n1.496442 4.485093 0.217825\n-0.051332 -0.153297 15.538161\nZn H C O\n1 18 11 4\ndirect\n0.364480 0.077461 0.161838 Zn\n0.193128 0.773973 0.493602 H\n0.470479 0.310860 0.400061 H\n0.300924 0.164270 0.912772 H\n0.070491 0.218307 0.717195 H\n0.503528 0.179798 0.751719 H\n0.262850 0.262380 0.559138 H\n0.702214 0.212646 0.591811 H\n0.630042 0.726816 0.526786 H\n0.888217 0.169801 0.873298 H\n0.547186 0.653596 0.956929 H\n0.966695 0.636171 0.996599 H\n0.782778 0.689875 0.803819 H\n0.213316 0.660258 0.837637 H\n-0.002765 0.730606 0.649226 H\n0.435752 0.682700 0.681649 H\n0.371238 0.834448 0.338610 H\n0.795476 0.805939 0.373597 H\n0.907279 0.271891 0.432725 H\n0.793657 0.295685 0.048053 C\n0.822082 0.496986 0.972655 C\n0.027420 0.317497 0.894072 C\n0.056546 0.524341 0.818558 C\n0.232048 0.349385 0.737042 C\n0.631529 0.439087 0.421766 C\n0.431328 0.387078 0.579178 C\n0.465082 0.600178 0.505852 C\n0.644900 0.668624 0.351347 C\n0.829241 0.540665 0.266325 C\n0.267993 0.556468 0.662256 C\n0.065956 0.051119 0.065205 O\n0.765413 0.708158 0.198437 O\n0.062885 0.266660 0.266262 O\n0.496554 0.379699 0.092338 O\n","nsites":34,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":1.7180594940634635,"density_atomic":0.12578430456380332,"volume":270.3039947464487,"volume_molar":4.787672659862985,"formula_full":"Zn1 H18 C11 O4","formula_reduced":"ZnH18C11O4","formula_anonymous":"AB4C11D18","energy_above_hull":4.575634835294118,"spacegroup":1},{"id":"jvasp-101810","created_at":"2022-09-04T14:36:46.898942Z","updated_at":"2022-09-04T14:36:46.898963Z","structure_string":"H6 C6 S1 O1\n1.0\n4.058739 -0.014887 0.539164\n-0.469319 5.279618 1.919758\n-0.221144 0.184899 6.369715\nH C S O\n6 6 1 1\ndirect\n0.812875 -0.028118 0.182636 H\n0.458279 0.235139 0.473459 H\n0.399662 0.927617 0.927255 H\n0.058900 0.566533 0.283024 H\n0.790890 0.033558 0.550952 H\n0.469610 0.152983 0.114025 H\n0.257174 0.765617 0.918904 C\n0.073671 0.566111 0.111736 C\n0.918101 0.378508 0.060193 C\n0.235432 0.724237 0.722005 C\n0.589221 0.081250 0.444170 C\n0.698281 0.141046 0.193987 C\n-0.003559 0.443245 0.768949 S\n0.361449 0.854766 0.502389 O\n","nsites":14,"nelements":4,"elements":["H","C","S","O"],"chemical_system":"C-H-O-S","density":1.5451613865302805,"density_atomic":0.10324646793837655,"volume":135.5978589829921,"volume_molar":5.832781382501492,"formula_full":"H6 C6 S1 O1","formula_reduced":"H6C6SO","formula_anonymous":"ABC6D6","energy_above_hull":4.93298025,"spacegroup":1}]}