{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=4564","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=4562","results":[{"id":"jvasp-44231","created_at":"2022-09-04T14:38:08.931809Z","updated_at":"2022-09-04T14:38:08.931837Z","structure_string":"Na4 Ni4 O6\n1.0\n0.000000 5.741578 -0.057673\n5.393984 0.000000 0.000000\n0.000000 -2.939537 -5.376154\nNa Ni O\n4 4 6\ndirect\n0.151844 0.344855 0.892431 Na\n0.151845 0.155145 0.392431 Na\n0.848154 0.844854 0.607568 Na\n0.848155 0.655145 0.107568 Na\n0.341055 0.640966 0.589065 Ni\n0.658944 0.140967 0.910933 Ni\n0.341055 0.859033 0.089066 Ni\n0.658944 0.359033 0.410933 Ni\n-0.000000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.340732 0.930554 0.766310 O\n0.340733 0.569445 0.266310 O\n0.659266 0.430555 0.733688 O\n0.659267 0.069445 0.233689 O\n","nsites":14,"nelements":3,"elements":["Na","Ni","O"],"chemical_system":"Na-Ni-O","density":4.192951873155848,"density_atomic":0.08362510850951403,"volume":167.41383359050852,"volume_molar":7.20135479323756,"formula_full":"Na4 Ni4 O6","formula_reduced":"Na2Ni2O3","formula_anonymous":"A2B2C3","energy_above_hull":1.1346204714285717,"spacegroup":14},{"id":"jvasp-46396","created_at":"2022-09-04T14:38:09.530023Z","updated_at":"2022-09-04T14:38:09.530039Z","structure_string":"Na4 Mn4 O6\n1.0\n0.000000 5.691439 0.056448\n6.299065 0.000000 0.000000\n0.000000 -2.691217 -5.527442\nNa Mn O\n4 4 6\ndirect\n0.064780 0.362670 0.758451 Na\n0.564780 0.137330 0.758451 Na\n0.435219 0.862670 0.241549 Na\n0.935219 0.637331 0.241548 Na\n0.480320 0.621182 0.697986 Mn\n0.019679 0.121182 0.302013 Mn\n0.980320 0.878819 0.697986 Mn\n0.519679 0.378818 0.302013 Mn\n0.500000 0.500000 -0.000000 O\n0.000000 0.000000 0.000000 O\n0.241668 0.879108 0.552817 O\n0.258331 0.379108 0.447182 O\n0.741668 0.620893 0.552817 O\n0.758331 0.120893 0.447182 O\n","nsites":14,"nelements":3,"elements":["Na","Mn","O"],"chemical_system":"Mn-Na-O","density":3.433032018192178,"density_atomic":0.07099175688888183,"volume":197.20599423836163,"volume_molar":8.482873257279735,"formula_full":"Na4 Mn4 O6","formula_reduced":"Na2Mn2O3","formula_anonymous":"A2B2C3","energy_above_hull":2.127570426108374,"spacegroup":14},{"id":"jvasp-12474","created_at":"2022-09-04T14:38:33.289106Z","updated_at":"2022-09-04T14:38:33.289122Z","structure_string":"Hg6 Cl4 O4\n1.0\n0.000000 6.376379 -0.002578\n7.039711 0.000000 0.000000\n0.000000 -2.752960 -6.337338\nHg Cl O\n6 4 4\ndirect\n0.417201 0.865823 0.757809 Hg\n0.582799 0.365823 0.742192 Hg\n0.582799 0.134177 0.242192 Hg\n0.417201 0.634177 0.257809 Hg\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Hg\n0.788076 0.627250 0.049993 Cl\n0.211925 0.127250 0.450007 Cl\n0.788076 0.872750 0.549993 Cl\n0.211925 0.372750 0.950007 Cl\n0.329455 0.605015 0.561922 O\n0.670545 0.105015 0.938079 O\n0.670545 0.394985 0.438079 O\n0.329455 0.894985 0.061922 O\n","nsites":14,"nelements":3,"elements":["Hg","Cl","O"],"chemical_system":"Cl-Hg-O","density":8.225375647643054,"density_atomic":0.04920575984804688,"volume":284.51953680287903,"volume_molar":12.238690711406697,"formula_full":"Hg6 Cl4 O4","formula_reduced":"Hg3(ClO)2","formula_anonymous":"A2B2C3","energy_above_hull":0.229200014285714,"spacegroup":14},{"id":"jvasp-5587","created_at":"2022-09-04T14:38:37.866190Z","updated_at":"2022-09-04T14:38:37.866216Z","structure_string":"U3 Si2 C2\n1.0\n3.596336 -0.000000 -0.668751\n-0.124357 3.594185 -0.668751\n-0.207040 -0.214328 8.890968\nU Si C\n3 2 2\ndirect\n0.826377 0.826378 0.652754 U\n0.173623 0.173623 0.347246 U\n0.000000 0.000000 0.000000 U\n0.584151 0.584151 0.168302 Si\n0.415849 0.415849 0.831699 Si\n0.695380 0.695380 0.390759 C\n0.304621 0.304621 0.609242 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0.259643 0.866312 Mn\n0.740357 0.039926 0.633687 Mn\n0.460074 0.240357 0.383687 Mn\n0.759642 0.539925 0.116312 Mn\n0.755618 0.505991 0.895954 O\n0.185847 0.185847 0.000000 O\n0.685846 0.314153 0.250000 O\n0.814153 0.814153 0.500000 O\n0.744381 0.005991 0.854045 O\n0.255619 0.994009 0.354045 O\n0.314153 0.685846 0.750000 O\n0.244381 0.494009 0.395954 O\n0.994009 0.255619 0.645954 O\n0.505991 0.755618 0.104046 O\n0.494009 0.244381 0.604045 O\n0.005991 0.744381 0.145954 O\n","nsites":28,"nelements":3,"elements":["Na","Mn","O"],"chemical_system":"Mn-Na-O","density":3.5195513802836054,"density_atomic":0.0727808929899224,"volume":384.71635685861975,"volume_molar":8.274343048846427,"formula_full":"Na8 Mn8 O12","formula_reduced":"Na2Mn2O3","formula_anonymous":"A2B2C3","energy_above_hull":2.124118997536945,"spacegroup":96},{"id":"jvasp-110280","created_at":"2022-09-04T14:38:37.106993Z","updated_at":"2022-09-04T14:38:37.107001Z","structure_string":"Bi2 Sb2 Te3\n1.0\n4.420726 0.021311 13.577788\n2.172392 3.850193 13.577788\n0.036293 0.021311 14.279280\nBi Sb Te\n2 2 3\ndirect\n0.853592 0.853590 0.853593 Bi\n0.146408 0.146408 0.146409 Bi\n0.712737 0.712735 0.712737 Sb\n0.287264 0.287263 0.287264 Sb\n0.580585 0.580583 0.580585 Te\n0.419416 0.419415 0.419416 Te\n0.000000 0.000000 0.000000 Te\n","nsites":7,"nelements":3,"elements":["Bi","Sb","Te"],"chemical_system":"Bi-Sb-Te","density":7.229982116504306,"density_atomic":0.029185616559303487,"volume":239.84417069882366,"volume_molar":20.63393366305405,"formula_full":"Bi2 Sb2 Te3","formula_reduced":"Bi2Sb2Te3","formula_anonymous":"A2B2C3","energy_above_hull":1.2502163000000002,"spacegroup":166},{"id":"jvasp-87978","created_at":"2022-09-04T14:35:51.711218Z","updated_at":"2022-09-04T14:35:51.711234Z","structure_string":"Hg12 Te8 I8\n1.0\n8.624853 0.000391 1.270532\n3.030121 8.075051 1.270532\n0.002744 0.001901 14.613257\nHg Te I\n12 8 8\ndirect\n0.676780 0.323219 0.750000 Hg\n0.500000 -0.000000 -0.000000 Hg\n-0.000000 0.500000 0.500000 Hg\n0.248211 0.694995 0.983815 Hg\n0.305005 0.751789 0.516185 Hg\n0.751789 0.305005 0.016185 Hg\n0.694994 0.248211 0.483815 Hg\n0.890072 0.863827 0.674547 Hg\n0.136172 0.109928 0.825453 Hg\n0.109928 0.136172 0.325453 Hg\n0.863827 0.890072 0.174547 Hg\n0.323219 0.676781 0.250000 Hg\n0.119105 0.592609 0.154989 Te\n0.141691 0.571246 0.635867 Te\n0.428753 0.858308 0.864134 Te\n0.858308 0.428754 0.364133 Te\n0.571246 0.141692 0.135867 Te\n0.592608 0.119105 0.654989 Te\n0.880894 0.407391 0.845011 Te\n0.407391 0.880894 0.345011 Te\n0.346628 0.388486 0.881751 I\n0.092889 0.129298 0.112583 I\n0.870701 0.907111 0.387417 I\n0.611513 0.653371 0.618249 I\n0.653371 0.611513 0.118249 I\n0.388486 0.346629 0.381751 I\n0.907110 0.870701 0.887417 I\n0.129298 0.092889 0.612583 I\n","nsites":28,"nelements":3,"elements":["Hg","Te","I"],"chemical_system":"Hg-I-Te","density":7.249664276187882,"density_atomic":0.027513079357017755,"volume":1017.6977879016674,"volume_molar":21.88828332101595,"formula_full":"Hg12 Te8 I8","formula_reduced":"Hg3(TeI)2","formula_anonymous":"A2B2C3","energy_above_hull":0.0,"spacegroup":15},{"id":"jvasp-15266","created_at":"2022-09-04T14:36:01.637105Z","updated_at":"2022-09-04T14:36:01.637132Z","structure_string":"Er2 Mo2 C3\n1.0\n3.194594 0.000000 -0.912013\n-0.568730 5.280676 -1.992145\n-0.004899 -0.016802 6.033845\nEr Mo C\n2 2 3\ndirect\n0.389553 0.174041 0.779108 Er\n0.610446 0.825960 0.220895 Er\n0.155766 0.327285 0.311533 Mo\n0.844233 0.672716 0.688469 Mo\n0.751631 0.263757 0.503265 C\n0.248367 0.736244 0.496738 C\n0.000000 0.000000 0.000000 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0.208673 Co\n0.529683 0.926458 0.749064 Co\n0.210848 0.658583 0.708673 Co\n0.073543 0.470317 0.249064 Co\n0.851527 0.570161 0.058195 O\n0.433203 0.714142 0.945366 O\n0.148474 0.429840 0.941804 O\n0.765510 -0.000284 0.941792 O\n0.285859 0.566798 0.445367 O\n0.570160 0.851527 0.441804 O\n0.000284 0.234490 0.441792 O\n-0.000284 0.765510 0.558206 O\n0.429840 0.148474 0.558195 O\n0.714141 0.433203 0.554633 O\n0.234490 0.000284 0.058208 O\n0.566798 0.285859 0.054633 O\n","nsites":28,"nelements":3,"elements":["Na","Co","O"],"chemical_system":"Co-Na-O","density":4.296825267347526,"density_atomic":0.08550277383729042,"volume":327.4747560036272,"volume_molar":7.0432109857160645,"formula_full":"Na8 Co8 O12","formula_reduced":"Na2Co2O3","formula_anonymous":"A2B2C3","energy_above_hull":1.8548400428571423,"spacegroup":15},{"id":"jvasp-119166","created_at":"2022-09-04T14:38:51.862133Z","updated_at":"2022-09-04T14:38:51.862160Z","structure_string":"Mo6 Se4 S4\n1.0\n6.576512 -0.087911 -0.203118\n-0.287198 6.550719 -0.231872\n-0.018846 -0.039118 6.588522\nMo Se S\n6 4 4\ndirect\n0.589385 0.458546 0.773615 Mo\n0.452739 0.774308 0.590031 Mo\n0.790727 0.603022 0.447642 Mo\n0.411607 0.546118 0.220755 Mo\n0.543693 0.221317 0.409732 Mo\n0.206669 0.407410 0.550042 Mo\n0.752539 0.379687 0.121364 Se\n0.365812 0.124242 0.750363 Se\n0.800201 0.805665 0.787164 Se\n0.200358 0.197314 0.214384 Se\n0.858573 0.279714 0.606534 S\n0.269708 0.607479 0.870448 S\n0.617761 0.869270 0.272437 S\n0.140219 0.725907 0.385486 S\n","nsites":14,"nelements":3,"elements":["Mo","Se","S"],"chemical_system":"Mo-S-Se","density":5.9711004626532365,"density_atomic":0.04936780991907321,"volume":283.58560006914774,"volume_molar":12.198517150896238,"formula_full":"Mo6 Se4 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