{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=structure_string&page=3502","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=structure_string&page=3500","results":[{"id":"jvasp-20658","created_at":"2022-09-04T14:38:10.450564Z","updated_at":"2022-09-04T14:38:10.450591Z","structure_string":"Si2 Ni1\n1.0\n3.352918 -0.000000 1.935808\n1.117639 3.161162 1.935808\n-0.000000 0.000000 3.871616\nSi Ni\n2 1\ndirect\n0.750001 0.750000 0.750001 Si\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Ni\n","nsites":3,"nelements":2,"elements":["Si","Ni"],"chemical_system":"Ni-Si","density":4.648069196612537,"density_atomic":0.07310705572978404,"volume":41.0357108496956,"volume_molar":8.237427564117535,"formula_full":"Si2 Ni1","formula_reduced":"Si2Ni","formula_anonymous":"AB2","energy_above_hull":2.0758165333333327,"spacegroup":225},{"id":"jvasp-20751","created_at":"2022-09-04T14:37:36.978314Z","updated_at":"2022-09-04T14:37:36.978334Z","structure_string":"Si2 Ni1\n1.0\n3.352918 0.000000 1.935809\n1.117639 3.161162 1.935809\n-0.000000 -0.000000 3.871617\nSi Ni\n2 1\ndirect\n0.750001 0.749999 0.750001 Si\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Ni\n","nsites":3,"nelements":2,"elements":["Si","Ni"],"chemical_system":"Ni-Si","density":4.648067996062689,"density_atomic":0.07310703684696176,"volume":41.03572144881257,"volume_molar":8.23742969176335,"formula_full":"Si2 Ni1","formula_reduced":"Si2Ni","formula_anonymous":"AB2","energy_above_hull":2.0758165333333327,"spacegroup":225},{"id":"jvasp-18508","created_at":"2022-09-04T14:36:53.524116Z","updated_at":"2022-09-04T14:36:53.524142Z","structure_string":"Si2 Ni1 P3\n1.0\n3.412471 -0.000000 -0.974216\n-0.633334 4.812804 -2.218434\n-0.004743 0.011757 6.447073\nSi Ni P\n2 1 3\ndirect\n0.835041 0.077910 0.670081 Si\n0.164960 0.407828 0.329918 Si\n0.500001 0.753174 0.000000 Ni\n0.000001 0.994388 0.000001 P\n0.338081 0.349728 0.676158 P\n0.661921 0.673570 0.323842 P\n","nsites":6,"nelements":3,"elements":["Si","Ni","P"],"chemical_system":"Ni-P-Si","density":3.256353134806637,"density_atomic":0.05662627871926567,"volume":105.95787213470291,"volume_molar":10.634887010421044,"formula_full":"Si2 Ni1 P3","formula_reduced":"Si2NiP3","formula_anonymous":"AB2C3","energy_above_hull":2.953912683333334,"spacegroup":44},{"id":"jvasp-35498","created_at":"2022-09-04T14:37:30.646103Z","updated_at":"2022-09-04T14:37:30.646129Z","structure_string":"Si2 Ni1 Se4\n1.0\n-0.000000 3.517008 0.000000\n0.353965 0.000000 6.422996\n6.039959 -1.758503 -2.686732\nSi Ni Se\n2 1 4\ndirect\n0.266683 0.282271 0.533365 Si\n0.733318 0.717730 0.466635 Si\n0.000000 0.000000 0.000000 Ni\n0.125541 0.470521 0.251081 Se\n0.874460 0.529480 0.748919 Se\n0.378673 0.015842 0.757342 Se\n0.621329 0.984158 0.242657 Se\n","nsites":7,"nelements":3,"elements":["Si","Ni","Se"],"chemical_system":"Ni-Se-Si","density":5.116412341090199,"density_atomic":0.050076638920860665,"volume":139.78573943555898,"volume_molar":12.025848558880273,"formula_full":"Si2 Ni1 Se4","formula_reduced":"Si2NiSe4","formula_anonymous":"AB2C4","energy_above_hull":2.077627580952381,"spacegroup":12},{"id":"jvasp-37092","created_at":"2022-09-04T14:38:05.025199Z","updated_at":"2022-09-04T14:38:05.025224Z","structure_string":"Si2 Ni2\n1.0\n3.092850 0.000000 0.000000\n0.000000 3.275932 0.000000\n0.000000 0.000000 4.714908\nSi Ni\n2 2\ndirect\n0.000000 0.000000 0.840148 Si\n0.500000 0.500000 0.159853 Si\n0.000000 0.000000 0.340509 Ni\n0.500000 0.500000 0.659491 Ni\n","nsites":4,"nelements":2,"elements":["Si","Ni"],"chemical_system":"Ni-Si","density":6.032902060174258,"density_atomic":0.08373230223065418,"volume":47.77128889853467,"volume_molar":7.192135650840029,"formula_full":"Si2 Ni2","formula_reduced":"SiNi","formula_anonymous":"AB","energy_above_hull":1.2119504999999997,"spacegroup":59},{"id":"jvasp-95041","created_at":"2022-09-04T14:36:21.922537Z","updated_at":"2022-09-04T14:36:21.922563Z","structure_string":"Si2 Ni2 Sb2\n1.0\n4.075440 -0.000000 -0.000000\n0.000000 4.075440 -0.000000\n-0.000000 -0.000000 6.548671\nSi Ni Sb\n2 2 2\ndirect\n0.750000 0.750000 0.800743 Si\n0.250000 0.250000 0.199257 Si\n0.750000 0.250000 0.000000 Ni\n0.250000 0.750000 0.000000 Ni\n0.750000 0.750000 0.303694 Sb\n0.250000 0.250000 0.696305 Sb\n","nsites":6,"nelements":3,"elements":["Si","Ni","Sb"],"chemical_system":"Ni-Sb-Si","density":6.36742725103865,"density_atomic":0.05516315162024832,"volume":108.76825967640373,"volume_molar":10.916962833192255,"formula_full":"Si2 Ni2 Sb2","formula_reduced":"SiNiSb","formula_anonymous":"ABC","energy_above_hull":1.7363223666666667,"spacegroup":129},{"id":"jvasp-14749","created_at":"2022-09-04T14:36:43.713353Z","updated_at":"2022-09-04T14:36:43.713382Z","structure_string":"Si2 Ni4\n1.0\n1.961216 -3.396925 0.000000\n1.961216 3.396925 0.000000\n0.000000 -0.000000 5.019592\nSi Ni\n2 4\ndirect\n0.666668 0.333334 0.750000 Si\n0.333334 0.666668 0.250000 Si\n0.333334 0.666668 0.750000 Ni\n0.666668 0.333334 0.250000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n","nsites":6,"nelements":2,"elements":["Si","Ni"],"chemical_system":"Ni-Si","density":7.223531956100278,"density_atomic":0.08971012262615029,"volume":66.8820844778448,"volume_molar":6.712888784129875,"formula_full":"Si2 Ni4","formula_reduced":"SiNi2","formula_anonymous":"AB2","energy_above_hull":1.398861133333333,"spacegroup":194},{"id":"jvasp-11493","created_at":"2022-09-04T14:38:15.673871Z","updated_at":"2022-09-04T14:38:15.673903Z","structure_string":"Si2 Ni4 O8\n1.0\n4.965076 0.000000 2.866588\n1.655025 4.681119 2.866588\n0.000000 0.000000 5.733176\nSi Ni O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Si\n0.875001 0.875000 0.875000 Si\n0.500001 0.500001 0.500000 Ni\n0.500001 0.500001 1.000000 Ni\n0.000000 0.500001 0.499999 Ni\n0.500000 -0.000000 0.500000 Ni\n0.755864 0.755863 0.755863 O\n0.244137 0.244137 0.767590 O\n0.244138 0.767589 0.244137 O\n0.767589 0.244137 0.244137 O\n0.755864 0.232411 0.755865 O\n0.232413 0.755863 0.755863 O\n0.244137 0.244137 0.244137 O\n0.755864 0.755863 0.232411 O\n","nsites":14,"nelements":3,"elements":["Si","Ni","O"],"chemical_system":"Ni-O-Si","density":5.220713515739656,"density_atomic":0.10506478577207773,"volume":133.25111641469385,"volume_molar":5.731835567688806,"formula_full":"Si2 Ni4 O8","formula_reduced":"Si(NiO2)2","formula_anonymous":"AB2C4","energy_above_hull":2.1864696285714285,"spacegroup":227},{"id":"jvasp-96829","created_at":"2022-09-04T14:36:30.979523Z","updated_at":"2022-09-04T14:36:30.979564Z","structure_string":"Si2 Ni4 P8 O28\n1.0\n4.884937 0.000000 0.000000\n-2.442468 8.231611 -2.030851\n0.000000 -0.036934 12.255196\nSi Ni P O\n2 4 8 28\ndirect\n0.671047 0.000000 0.750000 Si\n0.328954 0.000000 0.250000 Si\n0.400123 0.504594 0.370744 Ni\n0.895529 0.495406 0.129257 Ni\n0.104471 0.504595 0.870744 Ni\n0.599877 0.495406 0.629257 Ni\n0.002119 0.251797 0.634659 P\n0.805848 0.274047 0.414508 P\n-0.002119 0.748204 0.365341 P\n0.531800 0.725953 0.085492 P\n0.249678 0.251797 0.134659 P\n0.468201 0.274048 0.914508 P\n0.750322 0.748204 0.865341 P\n0.194153 0.725953 0.585492 P\n0.909829 0.694622 0.634941 O\n0.685824 0.714801 0.382439 O\n0.733983 0.416621 0.955542 O\n0.184905 0.809874 0.483495 O\n0.784794 0.694622 0.134941 O\n0.317362 0.583380 0.544459 O\n0.897985 0.389339 0.706425 O\n0.458012 0.867773 0.170100 O\n0.818373 0.912432 0.826257 O\n0.375031 0.190126 0.016506 O\n0.682638 0.416621 0.455542 O\n0.491354 0.389339 0.206425 O\n0.314176 0.285200 0.617562 O\n0.094059 0.912431 0.326257 O\n0.215206 0.305378 0.865060 O\n0.624969 0.809874 0.983495 O\n0.508646 0.610661 0.793575 O\n0.541989 0.132228 0.829900 O\n0.102015 0.610661 0.293575 O\n0.409761 0.867773 0.670100 O\n0.590240 0.132227 0.329900 O\n0.028977 0.714801 0.882439 O\n0.971024 0.285199 0.117561 O\n0.181628 0.087569 0.173743 O\n0.815096 0.190127 0.516506 O\n0.905942 0.087569 0.673743 O\n0.090172 0.305378 0.365060 O\n0.266017 0.583379 0.044459 O\n","nsites":42,"nelements":4,"elements":["Si","Ni","P","O"],"chemical_system":"Ni-O-P-Si","density":3.3273697716336055,"density_atomic":0.08529199145643088,"volume":492.4260681784476,"volume_molar":7.060616896342783,"formula_full":"Si2 Ni4 P8 O28","formula_reduced":"SiNi2(P2O7)2","formula_anonymous":"AB2C4D14","energy_above_hull":2.972894971428571,"spacegroup":15},{"id":"jvasp-15432","created_at":"2022-09-04T14:35:55.921215Z","updated_at":"2022-09-04T14:35:55.921237Z","structure_string":"Si2 Ni6 B1\n1.0\n3.058774 -5.297952 0.000000\n3.058774 5.297952 -0.000000\n-0.000000 -0.000000 2.899640\nSi Ni B\n2 6 1\ndirect\n0.333332 0.666666 0.000000 Si\n0.666666 0.333332 0.000000 Si\n0.756084 0.756084 0.000000 Ni\n-0.000000 0.243915 0.000000 Ni\n0.389707 0.389707 0.500000 Ni\n-0.000000 0.610292 0.500000 Ni\n0.243915 -0.000000 0.000000 Ni\n0.610292 -0.000000 0.500000 Ni\n0.000000 0.000000 0.500000 B\n","nsites":9,"nelements":3,"elements":["Si","Ni","B"],"chemical_system":"B-Ni-Si","density":7.405957343592334,"density_atomic":0.09576636923626264,"volume":93.97871164768021,"volume_molar":6.28836699984202,"formula_full":"Si2 Ni6 B1","formula_reduced":"Si2Ni6B","formula_anonymous":"AB2C6","energy_above_hull":2.183651575925926,"spacegroup":189},{"id":"jvasp-78526","created_at":"2022-09-04T14:37:12.140293Z","updated_at":"2022-09-04T14:37:12.140302Z","structure_string":"Si2 O1\n1.0\n-2.304434 -2.989415 0.889980\n-1.436692 2.488423 -0.000000\n0.834756 0.481948 -4.563646\nSi O\n2 1\ndirect\n0.703510 0.351754 0.932809 Si\n0.426913 0.713455 0.214135 Si\n0.536175 0.268087 0.513057 O\n","nsites":3,"nelements":2,"elements":["Si","O"],"chemical_system":"O-Si","density":2.767379766675821,"density_atomic":0.06927584091424052,"volume":43.30514015288283,"volume_molar":8.692988321072942,"formula_full":"Si2 O1","formula_reduced":"Si2O","formula_anonymous":"AB2","energy_above_hull":2.348370233333333,"spacegroup":8},{"id":"jvasp-118308","created_at":"2022-09-04T14:38:51.089772Z","updated_at":"2022-09-04T14:38:51.089806Z","structure_string":"Si2 O2 F2\n1.0\n3.666965 0.000000 0.000000\n0.000000 2.782561 0.000000\n0.000000 0.000000 7.690181\nSi O F\n2 2 2\ndirect\n0.500000 0.000000 0.247503 Si\n0.000000 0.500000 0.752496 Si\n0.000000 0.000000 0.872440 O\n0.500000 0.500000 0.127560 O\n0.500000 0.500000 0.685966 F\n0.000000 0.000000 0.314033 F\n","nsites":6,"nelements":3,"elements":["Si","O","F"],"chemical_system":"F-O-Si","density":2.669964572733552,"density_atomic":0.07646509458673005,"volume":78.46717554497415,"volume_molar":7.875672936191069,"formula_full":"Si2 O2 F2","formula_reduced":"SiOF","formula_anonymous":"ABC","energy_above_hull":0.9116307941666666,"spacegroup":59}]}