{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=62","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=60","results":[{"id":"jvasp-111046","created_at":"2022-09-04T14:38:37.811085Z","updated_at":"2022-09-04T14:38:37.811113Z","structure_string":"In2 Cu1 Te3 Br1\n1.0\n5.691657 0.067173 2.549537\n-1.108245 5.515846 2.405241\n0.012077 0.004034 7.502907\nIn Cu Te Br\n2 1 3 1\ndirect\n0.989629 0.969639 0.000427 In\n0.716776 0.245744 0.527155 In\n0.574668 0.551337 0.964776 Cu\n0.921148 0.413382 0.732681 Te\n0.373818 0.816436 0.743187 Te\n0.560354 0.630215 0.276808 Te\n0.113614 0.123244 0.254967 Br\n","nsites":7,"nelements":4,"elements":["In","Cu","Te","Br"],"chemical_system":"Br-Cu-In-Te","density":5.321424990985521,"density_atomic":0.029677040248661513,"volume":235.8725783079299,"volume_molar":20.29225525706395,"formula_full":"In2 Cu1 Te3 Br1","formula_reduced":"In2CuTe3Br","formula_anonymous":"ABC2D3","energy_above_hull":0.1557453992857143,"spacegroup":1},{"id":"jvasp-118271","created_at":"2022-09-04T14:38:38.207121Z","updated_at":"2022-09-04T14:38:38.207141Z","structure_string":"In1 O2 F1\n1.0\n3.544127 -0.135980 -0.184159\n-0.210646 3.677402 0.394986\n-0.187314 -1.188069 3.893486\nIn O F\n1 2 1\ndirect\n0.031102 0.052386 -0.047061 In\n0.346509 0.586333 0.106371 O\n0.491314 0.731375 0.802781 O\n-0.095343 0.171295 0.461491 F\n","nsites":4,"nelements":3,"elements":["In","O","F"],"chemical_system":"F-In-O","density":5.281516301697031,"density_atomic":0.07672646172904278,"volume":52.13325246413527,"volume_molar":7.848844615390985,"formula_full":"In1 O2 F1","formula_reduced":"InO2F","formula_anonymous":"ABC2","energy_above_hull":0.878348375,"spacegroup":1},{"id":"jvasp-112116","created_at":"2022-09-04T14:38:43.064504Z","updated_at":"2022-09-04T14:38:43.064525Z","structure_string":"Cd1 H14 C9 O4\n1.0\n4.057142 0.196317 0.482377\n1.391549 4.532208 -0.212011\n-0.359528 0.282863 12.759564\nCd H C O\n1 14 9 4\ndirect\n0.493375 0.269030 0.177079 Cd\n0.121124 0.652768 0.537090 H\n0.260485 0.043001 0.841627 H\n0.857174 0.029099 0.897390 H\n0.054587 0.100713 0.660082 H\n0.644127 0.095093 0.713163 H\n0.715554 0.643794 0.592821 H\n0.825645 0.163162 0.472490 H\n0.547240 0.506455 0.899244 H\n0.145418 0.531245 0.966147 H\n0.338303 0.586484 0.721805 H\n0.928025 0.580241 0.774823 H\n0.518932 0.671814 0.421798 H\n0.366528 0.026968 0.367743 H\n0.426463 0.167046 0.538173 H\n0.394635 0.810359 0.033451 C\n0.301533 0.668195 0.937745 C\n0.115941 0.888694 0.859903 C\n0.078276 0.731278 0.757435 C\n0.675134 0.017624 0.497162 C\n0.863660 0.795962 0.574527 C\n0.589758 0.866703 0.399147 C\n0.891021 0.764317 0.312803 C\n0.903804 0.950084 0.677342 C\n0.280156 0.096073 0.045966 O\n0.102350 0.496460 0.313415 O\n0.932704 0.945114 0.244971 O\n0.591643 0.648358 0.096336 O\n","nsites":28,"nelements":4,"elements":["Cd","H","C","O"],"chemical_system":"C-Cd-H-O","density":2.1339501387616844,"density_atomic":0.1204980560043527,"volume":232.36889397608678,"volume_molar":4.997707813462538,"formula_full":"Cd1 H14 C9 O4","formula_reduced":"CdH14C9O4","formula_anonymous":"AB4C9D14","energy_above_hull":4.479605848214286,"spacegroup":1},{"id":"jvasp-112162","created_at":"2022-09-04T14:38:43.358788Z","updated_at":"2022-09-04T14:38:43.358819Z","structure_string":"Cd1 H2 C3 O4\n1.0\n3.729637 0.080758 0.214237\n0.671870 4.112751 0.464532\n0.130294 0.032400 6.480819\nCd H C O\n1 2 3 4\ndirect\n0.524596 0.721956 0.502528 Cd\n0.143527 0.507787 0.051789 H\n0.706190 0.526190 0.978072 H\n0.125630 0.220238 0.811226 C\n0.896989 0.131232 0.206102 C\n0.957595 0.351933 0.010746 C\n0.094485 0.852813 0.247508 O\n0.628660 0.235743 0.331678 O\n0.346190 0.951577 0.810848 O\n0.051981 0.413004 0.643022 O\n","nsites":10,"nelements":4,"elements":["Cd","H","C","O"],"chemical_system":"C-Cd-H-O","density":3.6008636837911974,"density_atomic":0.10111561029676293,"volume":98.89669825115159,"volume_molar":5.955698375676808,"formula_full":"Cd1 H2 C3 O4","formula_reduced":"CdH2C3O4","formula_anonymous":"AB2C3D4","energy_above_hull":3.623754375,"spacegroup":1},{"id":"jvasp-112026","created_at":"2022-09-04T14:38:43.370899Z","updated_at":"2022-09-04T14:38:43.370929Z","structure_string":"Ti1 H20 C11 O4\n1.0\n4.729766 -0.240666 1.099100\n0.080969 6.353156 1.544591\n-0.251441 -0.335518 10.077601\nTi H C O\n1 20 11 4\ndirect\n0.279233 0.299300 0.822441 Ti\n0.289633 0.357248 0.142082 H\n0.563342 0.221820 0.213009 H\n0.304927 0.893318 0.919762 H\n0.382095 0.518432 0.321775 H\n0.232117 0.711257 0.758859 H\n0.983982 0.643726 0.172403 H\n-0.091173 0.405985 0.293731 H\n0.918682 0.607601 0.724029 H\n0.024953 0.677889 0.412321 H\n0.491657 0.696088 0.163284 H\n0.254277 0.590732 0.611165 H\n0.882094 0.994916 0.264062 H\n0.528851 0.903822 0.307182 H\n-0.050377 0.955187 0.990325 H\n0.503392 0.920327 0.555040 H\n0.554291 0.163964 0.441359 H\n0.234759 0.022838 0.064073 H\n0.067479 0.165445 0.449355 H\n0.026144 0.917596 0.559456 H\n0.672028 0.592833 0.475840 H\n0.509026 0.369467 0.151219 C\n0.544194 0.547581 0.225712 C\n0.831624 0.564484 0.263747 C\n0.817934 0.679057 0.383588 C\n0.722080 0.904657 0.348568 C\n0.688190 0.385618 0.008278 C\n0.912691 0.060319 0.527878 C\n0.836371 0.160364 0.652750 C\n0.144084 0.587866 0.718770 C\n0.170550 0.007456 0.967888 C\n0.657342 0.015357 0.470978 C\n0.581250 0.219938 0.682369 O\n0.551854 0.397729 0.908164 O\n0.017660 0.179126 0.722552 O\n0.950740 0.378812 -0.010906 O\n","nsites":36,"nelements":4,"elements":["Ti","H","C","O"],"chemical_system":"C-H-O-Ti","density":1.4273790094350032,"density_atomic":0.11715389364384046,"volume":307.2881223175014,"volume_molar":5.140367573533586,"formula_full":"Ti1 H20 C11 O4","formula_reduced":"TiH20C11O4","formula_anonymous":"AB4C11D20","energy_above_hull":4.707780064814815,"spacegroup":1},{"id":"jvasp-114168","created_at":"2022-09-04T14:38:39.595880Z","updated_at":"2022-09-04T14:38:39.595903Z","structure_string":"Ca2 N2\n1.0\n4.652549 0.155993 0.080613\n-1.029435 -6.220659 0.349183\n1.357902 1.803527 -5.055104\nCa N\n2 2\ndirect\n0.960121 0.854716 0.988441 Ca\n0.395098 0.067330 0.467761 Ca\n0.487127 0.723170 0.964749 N\n0.225116 0.628817 0.933810 N\n","nsites":4,"nelements":2,"elements":["Ca","N"],"chemical_system":"Ca-N","density":1.2546075128824088,"density_atomic":0.02793922511816603,"volume":143.16789327844342,"volume_molar":21.554430140886105,"formula_full":"Ca2 N2","formula_reduced":"CaN","formula_anonymous":"AB","energy_above_hull":1.7859268349999995,"spacegroup":1},{"id":"jvasp-112388","created_at":"2022-09-04T14:38:39.661694Z","updated_at":"2022-09-04T14:38:39.661719Z","structure_string":"Mg8 Si6\n1.0\n5.627553 0.136823 -1.475139\n-0.833267 7.688746 -4.060503\n0.013172 0.269036 6.373993\nMg Si\n8 6\ndirect\n0.295792 0.734703 0.573669 Mg\n0.116914 0.167337 0.874179 Mg\n0.304963 0.690296 0.044010 Mg\n0.353155 0.396873 0.566521 Mg\n0.840751 0.530231 0.546279 Mg\n0.621034 0.110064 -0.000157 Mg\n0.808431 0.487479 0.039315 Mg\n0.787503 0.850970 0.421995 Mg\n-0.030676 0.187484 0.416283 Si\n0.680785 0.187398 0.629423 Si\n0.703433 0.757590 0.927595 Si\n0.407029 0.440875 0.183684 Si\n0.311485 0.004063 0.469128 Si\n0.049354 0.954550 0.058144 Si\n","nsites":14,"nelements":2,"elements":["Mg","Si"],"chemical_system":"Mg-Si","density":2.128603123254994,"density_atomic":0.04944509809475585,"volume":283.1423243042335,"volume_molar":12.179449514811878,"formula_full":"Mg8 Si6","formula_reduced":"Mg4Si3","formula_anonymous":"A3B4","energy_above_hull":1.2467558408163262,"spacegroup":1},{"id":"jvasp-112372","created_at":"2022-09-04T14:38:39.819363Z","updated_at":"2022-09-04T14:38:39.819382Z","structure_string":"Cu3 Ag3 P2 S8\n1.0\n6.310778 0.021687 0.030379\n0.031911 6.410882 0.046539\n0.016981 0.018002 7.720680\nCu Ag P S\n3 3 2 8\ndirect\n0.509241 0.681977 0.748974 Cu\n0.502968 0.701092 0.254774 Cu\n0.016563 0.325452 0.751546 Cu\n0.023803 0.310646 0.242925 Ag\n0.011265 0.842525 0.501367 Ag\n0.494419 0.137038 0.996406 Ag\n0.506737 0.187857 0.505361 P\n0.993422 0.813729 0.995622 P\n0.409454 0.871894 0.504701 S\n0.898388 0.124185 0.980170 S\n0.833719 0.203291 0.517474 S\n0.326908 0.775042 0.999465 S\n0.873055 0.655937 0.779329 S\n0.866449 0.682682 0.220997 S\n0.376043 0.342666 0.721882 S\n0.413567 0.343985 0.279008 S\n","nsites":16,"nelements":4,"elements":["Cu","Ag","P","S"],"chemical_system":"Ag-Cu-P-S","density":4.4269644450848675,"density_atomic":0.05122513060649071,"volume":312.3466901999982,"volume_molar":11.756223339403135,"formula_full":"Cu3 Ag3 P2 S8","formula_reduced":"Cu3Ag3(PS4)2","formula_anonymous":"A2B3C3D8","energy_above_hull":1.467070258125,"spacegroup":1},{"id":"jvasp-115910","created_at":"2022-09-04T14:38:39.870580Z","updated_at":"2022-09-04T14:38:39.870607Z","structure_string":"P1 Cl3\n1.0\n5.820916 -0.184168 1.206932\n-1.853546 -5.352269 0.939471\n-0.587796 0.955074 -3.906758\nP Cl\n1 3\ndirect\n0.645257 0.880338 -0.029312 P\n0.331292 0.914647 0.585481 Cl\n0.667133 0.555696 0.577284 Cl\n-0.038871 0.200136 0.065261 Cl\n","nsites":4,"nelements":2,"elements":["P","Cl"],"chemical_system":"Cl-P","density":2.036233512839034,"density_atomic":0.03571612384460332,"volume":111.99423591998763,"volume_molar":16.86112632547034,"formula_full":"P1 Cl3","formula_reduced":"PCl3","formula_anonymous":"AB3","energy_above_hull":0.6545469256250002,"spacegroup":1},{"id":"jvasp-114174","created_at":"2022-09-04T14:38:39.811140Z","updated_at":"2022-09-04T14:38:39.811148Z","structure_string":"Ca3 O1\n1.0\n5.566674 -0.508059 1.337729\n-0.216573 -3.714896 -0.507820\n-1.266380 -0.607401 -6.265405\nCa O\n3 1\ndirect\n0.020487 0.247336 0.849380 Ca\n0.423480 0.895715 0.541463 Ca\n0.712412 0.546086 0.224260 Ca\n0.645164 0.394330 0.544094 O\n","nsites":4,"nelements":2,"elements":["Ca","O"],"chemical_system":"Ca-O","density":1.8528350553485722,"density_atomic":0.032761521072592975,"volume":122.09445315853316,"volume_molar":18.381749573397833,"formula_full":"Ca3 O1","formula_reduced":"Ca3O","formula_anonymous":"AB3","energy_above_hull":0.39902271,"spacegroup":1},{"id":"jvasp-112062","created_at":"2022-09-04T14:38:43.130181Z","updated_at":"2022-09-04T14:38:43.130208Z","structure_string":"Ti1 H24 C13 O4\n1.0\n4.892578 0.018107 0.447287\n0.107315 6.342959 1.737824\n0.310317 0.350223 11.456363\nTi H C O\n1 24 13 4\ndirect\n0.943160 0.943092 0.843950 Ti\n0.542461 0.493762 0.170733 H\n0.482956 0.360270 0.064602 H\n0.708789 0.248836 0.503259 H\n0.972553 0.420013 0.106060 H\n0.407679 0.409381 0.509004 H\n0.294183 0.215673 0.326096 H\n0.934638 0.219820 0.345018 H\n0.838552 0.333970 0.864894 H\n0.183621 0.059392 0.135114 H\n0.235961 0.895300 0.281355 H\n0.066033 0.603706 0.769513 H\n0.036887 0.561459 0.208525 H\n0.669371 0.064076 0.211474 H\n0.806114 0.822441 0.194113 H\n0.843076 0.136722 0.010975 H\n0.926684 0.428224 0.632473 H\n0.642818 0.604715 0.628137 H\n0.069103 0.741424 0.476046 H\n0.159545 0.257637 0.927577 H\n0.116650 0.835371 0.637902 H\n0.642994 0.935523 0.434831 H\n0.512024 0.737539 0.383171 H\n0.378848 0.751354 0.739248 H\n0.997639 0.559039 0.397952 H\n0.398577 0.485519 0.105427 C\n0.811130 0.933410 0.249455 C\n0.112368 0.430281 0.172045 C\n0.112701 0.220596 0.276877 C\n0.102138 0.021315 0.232531 C\n0.702432 0.819192 0.383560 C\n0.427445 0.691797 0.002263 C\n0.766665 0.509785 0.576331 C\n0.584349 0.339643 0.557694 C\n0.480953 0.181348 0.677900 C\n0.157597 0.762590 0.733593 C\n0.957252 0.202206 0.919697 C\n0.901205 0.656905 0.455260 C\n0.676507 0.744312 0.958430 O\n0.667114 0.067289 0.741096 O\n0.221198 0.801067 0.964555 O\n0.230395 0.161849 0.712535 O\n","nsites":42,"nelements":4,"elements":["Ti","H","C","O"],"chemical_system":"C-H-O-Ti","density":1.3796777980979924,"density_atomic":0.11942800795316737,"volume":351.67630039069167,"volume_molar":5.04248614978283,"formula_full":"Ti1 H24 C13 O4","formula_reduced":"TiH24C13O4","formula_anonymous":"AB4C13D24","energy_above_hull":4.744092674603175,"spacegroup":1},{"id":"jvasp-114250","created_at":"2022-09-04T14:38:40.019267Z","updated_at":"2022-09-04T14:38:40.019289Z","structure_string":"Al2 B2\n1.0\n5.035570 0.186594 0.214865\n2.628930 -3.191665 -0.421217\n1.679491 2.236182 -2.468293\nAl B\n2 2\ndirect\n0.090701 -0.051768 0.066824 Al\n0.739610 0.716781 -0.006093 Al\n0.689327 0.246728 0.834973 B\n0.428730 0.184132 0.741300 B\n","nsites":4,"nelements":2,"elements":["Al","B"],"chemical_system":"Al-B","density":2.619918013766718,"density_atomic":0.08349539696714191,"volume":47.906832535620225,"volume_molar":7.212542222381318,"formula_full":"Al2 B2","formula_reduced":"AlB","formula_anonymous":"AB","energy_above_hull":2.136817691666667,"spacegroup":1}]}