{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-structure_string&page=109","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-structure_string&page=107","results":[{"id":"jvasp-35949","created_at":"2022-09-04T14:38:35.188581Z","updated_at":"2022-09-04T14:38:35.188607Z","structure_string":"Zn2 In4 Se8\n1.0\n-5.634605 -5.634605 0.000000\n-5.634605 -0.000000 -5.634605\n0.000000 -5.634605 -5.634605\nZn In Se\n2 4 8\ndirect\n0.375000 0.375000 0.375000 Zn\n0.625001 0.625001 0.625001 Zn\n0.000000 0.000000 0.500000 In\n0.000000 0.500000 0.000000 In\n0.500000 0.000000 0.000000 In\n0.000000 0.000000 0.000000 In\n0.245789 0.245789 0.762633 Se\n0.245789 0.762633 0.245789 Se\n0.762633 0.245789 0.245789 Se\n0.245789 0.245789 0.245789 Se\n0.754212 0.754212 0.237368 Se\n0.754212 0.237368 0.754212 Se\n0.237368 0.754212 0.754212 Se\n0.754212 0.754212 0.754212 Se\n","nsites":14,"nelements":3,"elements":["Zn","In","Se"],"chemical_system":"In-Se-Zn","density":5.670457893407581,"density_atomic":0.03912979846237527,"volume":357.7835958818319,"volume_molar":15.390165542995343,"formula_full":"Zn2 In4 Se8","formula_reduced":"Zn(InSe2)2","formula_anonymous":"AB2C4","energy_above_hull":0.4120748295238094,"spacegroup":227},{"id":"jvasp-12403","created_at":"2022-09-04T14:36:42.310747Z","updated_at":"2022-09-04T14:36:42.310761Z","structure_string":"Zn2 In4 S8\n1.0\n6.564241 0.000000 3.789866\n2.188080 6.188825 3.789866\n0.000000 0.000000 7.579732\nZn In S\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.875000 0.875001 0.875001 Zn\n0.500000 0.500000 0.000000 In\n0.500000 0.500000 0.500000 In\n-0.000000 0.500000 0.500000 In\n0.500000 -0.000000 0.500000 In\n0.745934 0.745935 0.745935 S\n0.254065 0.254066 0.737805 S\n0.254065 0.737806 0.254066 S\n0.737805 0.254066 0.254066 S\n0.745934 0.262195 0.745935 S\n0.262195 0.745935 0.745935 S\n0.254065 0.254066 0.254065 S\n0.745934 0.745935 0.262196 S\n","nsites":14,"nelements":3,"elements":["Zn","In","S"],"chemical_system":"In-S-Zn","density":4.56547449846844,"density_atomic":0.04546544702478843,"volume":307.92614867213325,"volume_molar":13.245532935630525,"formula_full":"Zn2 In4 S8","formula_reduced":"Zn(InS2)2","formula_anonymous":"AB2C4","energy_above_hull":0.7616857100000001,"spacegroup":227},{"id":"jvasp-29484","created_at":"2022-09-04T14:38:13.285276Z","updated_at":"2022-09-04T14:38:13.285295Z","structure_string":"Zn2 In4 S8\n1.0\n3.914873 -0.000000 -0.000000\n-1.957436 3.390380 -0.000000\n-0.000000 -0.000000 24.756149\nZn In S\n2 4 8\ndirect\n0.000000 0.000000 0.912996 Zn\n0.000000 0.000000 0.412996 Zn\n0.666666 0.333333 0.594368 In\n0.333332 0.666667 0.094368 In\n0.333332 0.666667 0.756440 In\n0.666666 0.333333 0.256440 In\n0.333332 0.666667 0.934373 S\n0.666666 0.333333 0.434373 S\n0.666666 0.333333 0.693940 S\n0.000000 0.000000 0.807581 S\n0.000000 0.000000 0.050802 S\n0.333332 0.666667 0.193940 S\n0.000000 0.000000 0.307581 S\n0.000000 0.000000 0.550802 S\n","nsites":14,"nelements":3,"elements":["Zn","In","S"],"chemical_system":"In-S-Zn","density":4.27841933381215,"density_atomic":0.04260679752707451,"volume":328.58606636895655,"volume_molar":14.134225310346848,"formula_full":"Zn2 In4 S8","formula_reduced":"Zn(InS2)2","formula_anonymous":"AB2C4","energy_above_hull":0.7696842814285715,"spacegroup":186},{"id":"jvasp-5101","created_at":"2022-09-04T14:37:12.871718Z","updated_at":"2022-09-04T14:37:12.871741Z","structure_string":"Zn2 In4 S8\n1.0\n1.963964 -3.401683 0.000000\n1.963964 3.401683 -0.000000\n-0.000000 -0.000000 24.896043\nZn In S\n2 4 8\ndirect\n0.333332 0.666666 0.043619 Zn\n0.666666 0.333332 0.956381 Zn\n0.333332 0.666666 0.606269 In\n0.666666 0.333332 0.393730 In\n-0.000000 0.000000 0.231541 In\n-0.000000 0.000000 0.768459 In\n0.666666 0.333332 0.062191 S\n0.333332 0.666666 0.703147 S\n0.666666 0.333332 0.560444 S\n0.333332 0.666666 0.439556 S\n0.666666 0.333332 0.296853 S\n0.666666 0.333332 0.816971 S\n0.333332 0.666666 0.937809 S\n0.333332 0.666666 0.183029 S\n","nsites":14,"nelements":3,"elements":["Zn","In","S"],"chemical_system":"In-S-Zn","density":4.22614903095331,"density_atomic":0.042086261778513115,"volume":332.6501192640401,"volume_molar":14.309041728848836,"formula_full":"Zn2 In4 S8","formula_reduced":"Zn(InS2)2","formula_anonymous":"AB2C4","energy_above_hull":0.7704328528571429,"spacegroup":164},{"id":"jvasp-50433","created_at":"2022-09-04T14:37:14.973980Z","updated_at":"2022-09-04T14:37:14.974005Z","structure_string":"Zn2 In4 O8\n1.0\n0.000000 4.508815 4.508815\n4.508815 0.000000 4.508815\n4.508815 4.508815 -0.000000\nZn In O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.874999 0.874999 0.874999 Zn\n0.499999 0.499999 0.000000 In\n0.499999 0.000000 0.499999 In\n0.000000 0.499999 0.499999 In\n0.499999 0.499999 0.499999 In\n0.255965 0.255965 0.255965 O\n0.732102 0.255965 0.255965 O\n0.255965 0.732102 0.255965 O\n0.255965 0.255965 0.732102 O\n0.744034 0.744034 0.267897 O\n0.744034 0.267897 0.744034 O\n0.744034 0.744034 0.744034 O\n0.267897 0.744034 0.744034 O\n","nsites":14,"nelements":3,"elements":["Zn","In","O"],"chemical_system":"In-O-Zn","density":6.50440880284475,"density_atomic":0.07636788996457651,"volume":183.32312188400053,"volume_molar":7.885697461057769,"formula_full":"Zn2 In4 O8","formula_reduced":"ZnIn2O4","formula_anonymous":"AB2C4","energy_above_hull":0.9171720485714284,"spacegroup":227},{"id":"jvasp-29356","created_at":"2022-09-04T14:37:59.092271Z","updated_at":"2022-09-04T14:37:59.092302Z","structure_string":"Zn2 In2 S5\n1.0\n3.840221 -0.020825 15.039401\n1.872226 3.352984 15.039401\n-0.035701 -0.020825 15.521907\nZn In S\n2 2 5\ndirect\n0.686925 0.686921 0.686924 Zn\n0.517613 0.517609 0.517612 Zn\n0.102849 0.102848 0.102849 In\n0.924623 0.924617 0.924622 In\n0.006272 0.006272 0.006272 S\n0.468689 0.468686 0.468688 S\n0.614004 0.614000 0.614003 S\n0.741153 0.741148 0.741152 S\n0.869886 0.869880 0.869884 S\n","nsites":9,"nelements":3,"elements":["Zn","In","S"],"chemical_system":"In-S-Zn","density":4.262149277447065,"density_atomic":0.044357657678227656,"volume":202.8961958561109,"volume_molar":13.576327234600317,"formula_full":"Zn2 In2 S5","formula_reduced":"Zn2In2S5","formula_anonymous":"A2B2C5","energy_above_hull":0.6927233333333335,"spacegroup":160},{"id":"jvasp-108719","created_at":"2022-09-04T14:38:17.600835Z","updated_at":"2022-09-04T14:38:17.600864Z","structure_string":"Zn2 In1 Cu1 Se4\n1.0\n5.294864 0.010607 -4.741308\n-1.050423 5.189635 -4.741308\n-0.008657 -0.010607 7.107426\nZn In Cu Se\n2 1 1 4\ndirect\n0.749999 0.250000 0.499999 Zn\n0.250000 0.749999 0.499999 Zn\n0.500000 0.500000 -0.000000 In\n0.000000 0.000000 0.000000 Cu\n0.363006 0.363006 0.469445 Se\n0.106440 0.636993 -0.000000 Se\n0.893560 0.893560 0.530553 Se\n0.636993 0.106440 -0.000000 Se\n","nsites":8,"nelements":4,"elements":["Zn","In","Cu","Se"],"chemical_system":"Cu-In-Se-Zn","density":5.326572304340013,"density_atomic":0.04105758606402766,"volume":194.848279378245,"volume_molar":14.667547065744959,"formula_full":"Zn2 In1 Cu1 Se4","formula_reduced":"Zn2InCuSe4","formula_anonymous":"ABC2D4","energy_above_hull":0.1449055858333333,"spacegroup":121},{"id":"jvasp-12519","created_at":"2022-09-04T14:37:05.636208Z","updated_at":"2022-09-04T14:37:05.636230Z","structure_string":"Zn2 I4 O12\n1.0\n0.000000 5.527940 0.006585\n5.022977 0.000000 0.000000\n0.000000 -0.081343 -9.491113\nZn I O\n2 4 12\ndirect\n0.232871 0.925030 0.744718 Zn\n0.767129 0.425030 0.255282 Zn\n0.261928 0.483462 0.068021 I\n0.738073 0.983462 0.931979 I\n0.266347 -0.005240 0.400482 I\n0.733653 0.494760 0.599518 I\n0.463406 0.649121 0.198674 O\n0.536594 0.149121 0.801326 O\n0.346824 0.701154 0.919707 O\n0.653177 0.201154 0.080293 O\n0.094007 0.201415 0.273238 O\n0.855011 0.637238 0.435029 O\n0.144989 0.137238 0.564972 O\n0.016375 0.161919 0.879770 O\n0.553582 0.182904 0.398313 O\n0.446419 0.682905 0.601687 O\n0.905993 0.701416 0.726762 O\n0.983626 0.661919 0.120230 O\n","nsites":18,"nelements":3,"elements":["Zn","I","O"],"chemical_system":"I-O-Zn","density":5.232559998662834,"density_atomic":0.06830229315342129,"volume":263.5343437089033,"volume_molar":8.816893960606867,"formula_full":"Zn2 I4 O12","formula_reduced":"Zn(IO3)2","formula_anonymous":"AB2C6","energy_above_hull":1.5342715500000004,"spacegroup":4},{"id":"jvasp-54925","created_at":"2022-09-04T14:38:33.195829Z","updated_at":"2022-09-04T14:38:33.195853Z","structure_string":"Zn2 I4\n1.0\n5.590322 -0.000000 0.000000\n-2.795162 4.841361 -0.000000\n0.000000 0.000000 8.194260\nZn I\n2 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.333333 0.666667 0.250000 I\n0.666667 0.333333 0.750000 I\n0.333333 0.666667 0.750000 I\n0.666667 0.333333 0.250000 I\n","nsites":6,"nelements":2,"elements":["Zn","I"],"chemical_system":"I-Zn","density":4.780269181593755,"density_atomic":0.027054357181989133,"volume":221.77573688553107,"volume_molar":22.259411744623204,"formula_full":"Zn2 I4","formula_reduced":"ZnI2","formula_anonymous":"AB2","energy_above_hull":0.3001133333333333,"spacegroup":191},{"id":"jvasp-95996","created_at":"2022-09-04T14:36:03.596269Z","updated_at":"2022-09-04T14:36:03.596293Z","structure_string":"Zn2 H8 N4 O16\n1.0\n5.600472 0.000000 -0.018244\n0.000000 5.988716 0.000000\n0.128025 0.000000 8.555735\nZn H N O\n2 8 4 16\ndirect\n0.500000 0.500000 0.000000 Zn\n0.499999 0.000000 0.500001 Zn\n0.696932 0.165553 0.891483 H\n0.303066 0.665553 0.608518 H\n0.303067 0.834448 0.108518 H\n0.696932 0.334448 0.391483 H\n0.911829 0.277688 0.980866 H\n0.088169 0.777688 0.519135 H\n0.088170 0.722313 0.019135 H\n0.911830 0.222313 0.480866 H\n0.243479 0.354580 0.303728 N\n0.756520 0.854581 0.196273 N\n0.243478 0.145420 0.803728 N\n0.756520 0.645420 0.696273 N\n0.229867 0.260705 0.931125 O\n0.261898 0.745500 0.511384 O\n0.738100 0.245499 0.988617 O\n0.229867 0.239295 0.431125 O\n0.770132 0.739295 0.068876 O\n0.770131 0.760706 0.568876 O\n0.451324 0.390976 0.244951 O\n0.060278 0.073794 0.742546 O\n0.548675 0.609025 0.755050 O\n0.451323 0.109025 0.744951 O\n0.060278 0.426207 0.242546 O\n0.939721 0.926207 0.257455 O\n0.939721 0.573794 0.757455 O\n0.261899 0.754501 0.011384 O\n0.548676 0.890976 0.255050 O\n0.738101 0.254501 0.488617 O\n","nsites":30,"nelements":4,"elements":["Zn","H","N","O"],"chemical_system":"H-N-O-Zn","density":2.60910320058344,"density_atomic":0.10454046134823705,"volume":286.9702277290162,"volume_molar":5.760583684377969,"formula_full":"Zn2 H8 N4 O16","formula_reduced":"ZnH4(NO4)2","formula_anonymous":"AB2C4D8","energy_above_hull":3.12172366,"spacegroup":14},{"id":"jvasp-30063","created_at":"2022-09-04T14:38:10.665042Z","updated_at":"2022-09-04T14:38:10.665067Z","structure_string":"Zn2 H8 Cl4 O12\n1.0\n6.398494 0.000000 -0.583194\n0.000000 6.825768 0.000000\n-0.056381 0.000000 6.378833\nZn H Cl O\n2 8 4 12\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.393849 0.918814 0.189361 H\n0.893848 0.581187 0.689361 H\n0.606151 0.081187 0.810639 H\n0.106151 0.418814 0.310639 H\n0.108203 0.647338 0.370642 H\n0.608202 0.852663 0.870642 H\n0.891797 0.352663 0.629359 H\n0.391797 0.147338 0.129358 H\n0.236915 0.105288 0.584354 Cl\n0.736914 0.394712 0.084355 Cl\n0.263085 0.605289 0.915645 Cl\n0.763085 0.894712 0.415646 Cl\n0.809862 0.477019 0.608898 O\n0.057316 0.729210 0.842425 O\n0.557316 0.770790 0.342426 O\n0.942683 0.270790 0.157575 O\n0.442684 0.229210 0.657574 O\n0.451632 0.660459 0.782767 O\n0.951632 0.839542 0.282767 O\n0.548367 0.339541 0.217234 O\n0.048368 0.160459 0.717233 O\n0.190138 0.522982 0.391102 O\n0.690137 0.977019 0.891102 O\n0.309862 0.022982 0.108898 O\n","nsites":26,"nelements":4,"elements":["Zn","H","Cl","O"],"chemical_system":"Cl-H-O-Zn","density":2.8196916824449034,"density_atomic":0.0934012826203996,"volume":278.3687682927107,"volume_molar":6.447599637871264,"formula_full":"Zn2 H8 Cl4 O12","formula_reduced":"ZnH4(ClO3)2","formula_anonymous":"AB2C4D6","energy_above_hull":2.160315348846154,"spacegroup":14},{"id":"jvasp-32216","created_at":"2022-09-04T14:36:02.911053Z","updated_at":"2022-09-04T14:36:02.911077Z","structure_string":"Zn2 H8 C4 O12\n1.0\n5.209607 -0.000000 1.793026\n2.559194 5.625834 1.029031\n0.075055 0.023285 8.246655\nZn H C O\n2 8 4 12\ndirect\n0.435761 0.749999 0.750000 Zn\n0.564239 0.250000 0.250000 Zn\n0.180377 0.190408 0.641564 H\n0.647772 0.311516 0.650719 H\n0.110008 0.188483 0.849281 H\n0.352228 0.688483 0.349281 H\n0.819623 0.809591 0.358436 H\n0.487648 0.690408 0.141564 H\n0.889992 0.811516 0.150719 H\n0.512351 0.309591 0.858436 H\n0.116993 0.248128 0.149717 C\n0.985163 0.748127 0.649717 C\n0.883007 0.751870 0.850283 C\n0.014836 0.251871 0.350283 C\n0.818767 0.746092 0.575962 O\n0.049377 0.752578 0.925191 O\n0.359176 0.246093 0.075962 O\n0.227148 0.747419 0.574809 O\n0.640823 0.753905 0.924038 O\n0.772852 0.252579 0.425191 O\n0.374660 0.625121 0.240082 O\n0.739863 0.874878 0.259918 O\n0.260136 0.125121 0.740082 O\n0.950623 0.247420 0.074809 O\n0.181232 0.253906 0.424038 O\n0.625340 0.374878 0.759918 O\n","nsites":26,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":2.611671627975519,"density_atomic":0.1079191693339313,"volume":240.92105378933115,"volume_molar":5.580232684488014,"formula_full":"Zn2 H8 C4 O12","formula_reduced":"ZnH4(CO3)2","formula_anonymous":"AB2C4D6","energy_above_hull":3.240247030769231,"spacegroup":15}]}