{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=4325","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=4323","results":[{"id":"jvasp-92433","created_at":"2022-09-04T14:36:06.350259Z","updated_at":"2022-09-04T14:36:06.350286Z","structure_string":"La1 Ni2 As2\n1.0\n3.873573 0.000000 -1.490771\n-0.573733 3.830849 -1.490771\n0.051934 0.060291 5.912816\nLa Ni As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.749999 0.250000 0.500000 Ni\n0.250000 0.750000 0.500001 Ni\n0.635626 0.635626 0.271252 As\n0.364373 0.364374 0.728749 As\n","nsites":5,"nelements":3,"elements":["La","Ni","As"],"chemical_system":"As-La-Ni","density":7.625808486917444,"density_atomic":0.05653740626605418,"volume":88.43702479860785,"volume_molar":10.651604234656542,"formula_full":"La1 Ni2 As2","formula_reduced":"La(NiAs)2","formula_anonymous":"AB2C2","energy_above_hull":1.66509666,"spacegroup":139},{"id":"jvasp-92434","created_at":"2022-09-04T14:36:07.411755Z","updated_at":"2022-09-04T14:36:07.411788Z","structure_string":"K1 Cr1 F3\n1.0\n4.151512 0.000000 0.000000\n0.000000 4.151750 0.000000\n0.000000 0.000000 4.151750\nK Cr F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Cr\n0.500000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.000000 0.500000 0.000000 F\n","nsites":5,"nelements":3,"elements":["K","Cr","F"],"chemical_system":"Cr-F-K","density":3.436410199767776,"density_atomic":0.06987170131365131,"volume":71.55972884580551,"volume_molar":8.618855197137462,"formula_full":"K1 Cr1 F3","formula_reduced":"KCrF3","formula_anonymous":"ABC3","energy_above_hull":0.3046977098333333,"spacegroup":221},{"id":"jvasp-92435","created_at":"2022-09-04T14:36:08.927170Z","updated_at":"2022-09-04T14:36:08.927198Z","structure_string":"K1 Mn1 F3\n1.0\n4.206075 -0.000000 -0.000000\n0.000000 4.206075 -0.000000\n-0.000000 -0.000000 4.206075\nK Mn F\n1 1 3\ndirect\n0.499999 0.499999 0.499999 K\n0.000000 0.000000 0.000000 Mn\n0.499999 0.000000 0.000000 F\n0.000000 0.000000 0.499999 F\n0.000000 0.499999 0.000000 F\n","nsites":5,"nelements":3,"elements":["K","Mn","F"],"chemical_system":"F-K-Mn","density":3.37043342225854,"density_atomic":0.06719531078065104,"volume":74.4099542350767,"volume_molar":8.962144366975801,"formula_full":"K1 Mn1 F3","formula_reduced":"KMnF3","formula_anonymous":"ABC3","energy_above_hull":0.177807724137931,"spacegroup":221},{"id":"jvasp-92436","created_at":"2022-09-04T14:35:42.711745Z","updated_at":"2022-09-04T14:35:42.711767Z","structure_string":"K1 Fe1 F3\n1.0\n4.116688 -0.000000 -0.000000\n-0.000000 4.116688 -0.000000\n-0.000000 0.000000 4.116688\nK Fe F\n1 1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Fe\n0.000000 0.500000 0.500000 F\n0.500000 0.000000 0.500000 F\n0.500000 0.500000 0.000000 F\n","nsites":5,"nelements":3,"elements":["K","Fe","F"],"chemical_system":"F-Fe-K","density":3.6163720086027453,"density_atomic":0.07166814174099212,"volume":69.76600590636137,"volume_molar":8.402814156621991,"formula_full":"K1 Fe1 F3","formula_reduced":"KFeF3","formula_anonymous":"ABC3","energy_above_hull":0.009575175,"spacegroup":221},{"id":"jvasp-92438","created_at":"2022-09-04T14:35:45.335625Z","updated_at":"2022-09-04T14:35:45.335641Z","structure_string":"Nd3 In1 N1\n1.0\n6.574522 -0.808058 2.006837\n-0.714346 4.110512 -0.323823\n3.163111 -1.074182 6.153580\nNd In N\n3 1 1\ndirect\n0.540671 0.821943 0.103624 Nd\n0.246017 0.033199 0.821095 Nd\n-0.030157 0.258158 0.545176 Nd\n0.735858 0.538992 0.342085 In\n0.007606 0.847706 0.688021 N\n","nsites":5,"nelements":3,"elements":["Nd","In","N"],"chemical_system":"In-N-Nd","density":6.819637016347879,"density_atomic":0.03656732513978333,"volume":136.73409200390932,"volume_molar":16.468638974766648,"formula_full":"Nd3 In1 N1","formula_reduced":"Nd3InN","formula_anonymous":"ABC3","energy_above_hull":1.893883544,"spacegroup":8},{"id":"jvasp-92439","created_at":"2022-09-04T14:35:48.393176Z","updated_at":"2022-09-04T14:35:48.393200Z","structure_string":"Np1 O2 F2\n1.0\n3.836105 -0.053125 4.097334\n1.583495 3.494435 4.097334\n-0.083665 -0.053125 5.612206\nNp O F\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.883174 0.883178 0.883171 O\n0.116826 0.116826 0.116825 O\n0.336647 0.336649 0.336646 F\n0.663352 0.663355 0.663350 F\n","nsites":5,"nelements":3,"elements":["Np","O","F"],"chemical_system":"F-Np-O","density":6.585406016708208,"density_atomic":0.06459089508336491,"volume":77.4102912422362,"volume_molar":9.323513402666832,"formula_full":"Np1 O2 F2","formula_reduced":"Np(OF)2","formula_anonymous":"AB2C2","energy_above_hull":1.849947513,"spacegroup":166},{"id":"jvasp-9244","created_at":"2022-09-04T14:38:13.767499Z","updated_at":"2022-09-04T14:38:13.767526Z","structure_string":"Mg2 V4 O12\n1.0\n4.826741 -0.139798 0.000993\n-0.154682 5.264395 0.007586\n-0.001599 -0.010664 8.134043\nMg V O\n2 4 12\ndirect\n0.586793 0.495144 0.751731 Mg\n0.086937 -0.003952 0.248296 Mg\n0.470258 0.988586 0.941895 V\n0.970165 0.488856 0.058100 V\n0.049150 0.476609 0.518310 V\n0.549150 0.976423 0.481710 V\n0.676907 0.993784 0.289532 O\n0.176843 0.493967 0.710493 O\n0.707877 0.751057 0.932968 O\n0.207182 0.774297 0.060895 O\n0.726609 0.273368 0.567556 O\n0.707618 0.273605 0.939212 O\n0.208309 0.251852 0.066941 O\n0.351605 -0.002343 0.752557 O\n0.226222 0.773847 0.432474 O\n0.734292 0.748408 0.574109 O\n0.234733 0.248970 0.425876 O\n0.851529 0.497456 0.247450 O\n","nsites":18,"nelements":3,"elements":["Mg","V","O"],"chemical_system":"Mg-O-V","density":3.5731613886433924,"density_atomic":0.08716306258782969,"volume":206.50949456786623,"volume_molar":6.9090513586897,"formula_full":"Mg2 V4 O12","formula_reduced":"MgV2O6","formula_anonymous":"AB2C6","energy_above_hull":2.6534364944444446,"spacegroup":7},{"id":"jvasp-92440","created_at":"2022-09-04T14:35:51.827456Z","updated_at":"2022-09-04T14:35:51.827472Z","structure_string":"Fe1 Bi1 O3\n1.0\n-2.749677 -1.587526 2.319634\n2.749677 -1.587526 2.319634\n-0.000000 3.175053 2.319634\nFe Bi O\n1 1 3\ndirect\n0.943269 0.943269 0.943266 Fe\n0.512028 0.512028 0.512026 Bi\n0.918196 0.435448 0.918193 O\n0.435448 0.918196 0.918193 O\n0.918196 0.918196 0.435446 O\n","nsites":5,"nelements":3,"elements":["Fe","Bi","O"],"chemical_system":"Bi-Fe-O","density":8.550180281779221,"density_atomic":0.08229940004214023,"volume":60.75378432211926,"volume_molar":7.317356817809667,"formula_full":"Fe1 Bi1 O3","formula_reduced":"FeBiO3","formula_anonymous":"ABC3","energy_above_hull":2.19907006,"spacegroup":160},{"id":"jvasp-92443","created_at":"2022-09-04T14:35:55.536667Z","updated_at":"2022-09-04T14:35:55.536691Z","structure_string":"Gd1 P2 Ru2\n1.0\n3.794349 0.000000 -1.465501\n-0.566024 3.751892 -1.465501\n-0.000039 -0.000046 5.644645\nGd P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Gd\n0.373512 0.373511 0.747024 P\n0.626489 0.626487 0.252975 P\n0.750000 0.249999 0.500000 Ru\n0.250001 0.749999 0.500000 Ru\n","nsites":5,"nelements":3,"elements":["Gd","P","Ru"],"chemical_system":"Gd-P-Ru","density":8.706783535038635,"density_atomic":0.062222651729653376,"volume":80.35658817184668,"volume_molar":9.678373699284236,"formula_full":"Gd1 P2 Ru2","formula_reduced":"Gd(PRu)2","formula_anonymous":"AB2C2","energy_above_hull":4.3434491,"spacegroup":139},{"id":"jvasp-92445","created_at":"2022-09-04T14:35:58.437971Z","updated_at":"2022-09-04T14:35:58.437996Z","structure_string":"Eu1 Mn2 Ge2\n1.0\n3.758194 -0.000000 -1.380046\n-0.506767 3.723869 -1.380046\n0.158654 0.181706 6.239304\nEu Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Eu\n0.249999 0.750001 0.499999 Mn\n0.749999 0.250001 0.499999 Mn\n0.373960 0.373962 0.747921 Ge\n0.626038 0.626039 0.252077 Ge\n","nsites":5,"nelements":3,"elements":["Eu","Mn","Ge"],"chemical_system":"Eu-Ge-Mn","density":7.578568003402776,"density_atomic":0.05605127874123776,"volume":89.20403088540824,"volume_molar":10.743984607026318,"formula_full":"Eu1 Mn2 Ge2","formula_reduced":"Eu(MnGe)2","formula_anonymous":"AB2C2","energy_above_hull":2.229405276551724,"spacegroup":139},{"id":"jvasp-92446","created_at":"2022-09-04T14:36:03.185654Z","updated_at":"2022-09-04T14:36:03.185676Z","structure_string":"Th1 Ge2 Ru2\n1.0\n4.006780 0.000017 -1.579142\n-0.622510 3.958234 -1.579200\n-0.006888 -0.008143 5.854154\nTh Ge Ru\n1 2 2\ndirect\n0.001550 0.000500 0.999824 Th\n0.370953 0.369914 0.738596 Ge\n0.632157 0.631091 0.261047 Ge\n0.751577 0.250463 0.499810 Ru\n0.251537 0.750542 0.499834 Ru\n","nsites":5,"nelements":3,"elements":["Th","Ge","Ru"],"chemical_system":"Ge-Ru-Th","density":10.375040998219967,"density_atomic":0.05391240679579408,"volume":92.7430307264648,"volume_molar":11.17023171087552,"formula_full":"Th1 Ge2 Ru2","formula_reduced":"Th(GeRu)2","formula_anonymous":"AB2C2","energy_above_hull":2.8449537000000005,"spacegroup":139},{"id":"jvasp-92448","created_at":"2022-09-04T14:36:07.124633Z","updated_at":"2022-09-04T14:36:07.124654Z","structure_string":"Ce1 Co2 P2\n1.0\n3.552811 -0.098256 -1.572616\n-0.599477 3.503247 -1.572616\n0.327908 0.378056 5.519218\nCe Co P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.249993 0.750008 0.500000 Co\n0.750007 0.249993 0.499999 Co\n0.370216 0.370217 0.740406 P\n0.629783 0.629784 0.259593 P\n","nsites":5,"nelements":3,"elements":["Ce","Co","P"],"chemical_system":"Ce-Co-P","density":7.308009809304114,"density_atomic":0.06878047634254514,"volume":72.69504757569088,"volume_molar":8.755596181114143,"formula_full":"Ce1 Co2 P2","formula_reduced":"Ce(CoP)2","formula_anonymous":"AB2C2","energy_above_hull":2.9337996600000005,"spacegroup":139}]}