{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density_atomic&page=114","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density_atomic&page=112","results":[{"id":"jvasp-29528","created_at":"2022-09-04T14:37:56.918094Z","updated_at":"2022-09-04T14:37:56.918125Z","structure_string":"Pb5 I10\n1.0\n4.588677 -0.000000 -0.000000\n-2.294339 3.973912 -0.000000\n0.000000 0.000000 35.214740\nPb I\n5 10\ndirect\n-0.000000 -0.000000 0.853002 Pb\n0.333333 0.666667 0.452924 Pb\n0.333333 0.666667 0.652641 Pb\n0.333333 0.666667 0.253090 Pb\n0.333333 0.666667 0.053336 Pb\n0.666667 0.333333 0.107152 I\n0.666667 0.333333 0.706430 I\n-0.000000 -0.000000 0.199287 I\n0.333333 0.666667 0.799205 I\n0.666667 0.333333 0.506718 I\n0.000000 0.000000 -0.000441 I\n0.666667 0.333333 0.306891 I\n0.666667 0.333333 0.906809 I\n-0.000000 -0.000000 0.399124 I\n-0.000000 -0.000000 0.598832 I\n","nsites":15,"nelements":2,"elements":["Pb","I"],"chemical_system":"I-Pb","density":5.9607132354993535,"density_atomic":0.023359365317239044,"volume":642.1407344030066,"volume_molar":25.780412602031202,"formula_full":"Pb5 I10","formula_reduced":"PbI2","formula_anonymous":"AB2","energy_above_hull":0.00024,"spacegroup":156},{"id":"jvasp-29529","created_at":"2022-09-04T14:38:04.098451Z","updated_at":"2022-09-04T14:38:04.098468Z","structure_string":"Pb7 I14\n1.0\n4.589174 -0.000000 -0.000000\n-2.294586 3.974341 0.000000\n-0.000000 -0.000000 49.286415\nPb I\n7 14\ndirect\n0.333332 0.666667 0.180921 Pb\n0.333332 0.666667 0.466349 Pb\n0.000000 0.000000 0.895024 Pb\n0.333332 0.666667 0.751779 Pb\n0.333332 0.666667 0.609018 Pb\n0.333332 0.666667 0.323707 Pb\n0.333332 0.666667 0.038193 Pb\n0.666666 0.333333 0.219360 I\n0.000000 0.000000 0.285273 I\n0.000000 0.000000 0.570590 I\n0.666666 0.333333 0.647451 I\n0.000000 0.000000 0.999769 I\n0.333332 0.666667 0.856587 I\n0.666666 0.333333 0.790215 I\n0.000000 0.000000 0.142488 I\n0.666666 0.333333 0.504778 I\n0.666666 0.333333 0.076636 I\n0.000000 0.000000 0.427923 I\n0.666666 0.333333 0.933468 I\n0.666666 0.333333 0.362135 I\n0.000000 0.000000 0.713334 I\n","nsites":21,"nelements":2,"elements":["Pb","I"],"chemical_system":"I-Pb","density":5.9611438758502535,"density_atomic":0.023361052948379746,"volume":898.932083515375,"volume_molar":25.778550193379356,"formula_full":"Pb7 I14","formula_reduced":"PbI2","formula_anonymous":"AB2","energy_above_hull":0.0002533333333333,"spacegroup":156},{"id":"jvasp-66291","created_at":"2022-09-04T14:35:47.410593Z","updated_at":"2022-09-04T14:35:47.410621Z","structure_string":"Ba1 Sb1 Te1\n1.0\n-0.000000 4.004124 4.004124\n4.004124 -0.000000 4.004124\n4.004124 4.004124 -0.000000\nBa Sb Te\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Te\n","nsites":3,"nelements":3,"elements":["Ba","Sb","Te"],"chemical_system":"Ba-Sb-Te","density":5.000991527385423,"density_atomic":0.023365157034932717,"volume":128.39631231730084,"volume_molar":25.774022194656915,"formula_full":"Ba1 Sb1 Te1","formula_reduced":"BaSbTe","formula_anonymous":"ABC","energy_above_hull":0.5229566122222222,"spacegroup":216},{"id":"jvasp-29946","created_at":"2022-09-04T14:38:13.946194Z","updated_at":"2022-09-04T14:38:13.946223Z","structure_string":"Pb3 I6\n1.0\n4.846493 0.171701 20.755236\n2.536486 4.133307 20.755236\n0.294463 0.171701 21.311537\nPb I\n3 6\ndirect\n0.000000 0.000000 0.000000 Pb\n0.555463 0.555464 0.555464 Pb\n0.444536 0.444537 0.444537 Pb\n0.081334 0.081334 0.081334 I\n0.303451 0.303452 0.303452 I\n0.807757 0.807758 0.807758 I\n0.192242 0.192242 0.192242 I\n0.918665 0.918667 0.918667 I\n0.696548 0.696549 0.696549 I\n","nsites":9,"nelements":2,"elements":["Pb","I"],"chemical_system":"I-Pb","density":5.962205806969824,"density_atomic":0.023365214537099707,"volume":385.18798899576285,"volume_molar":25.773958764375717,"formula_full":"Pb3 I6","formula_reduced":"PbI2","formula_anonymous":"AB2","energy_above_hull":0.0003233333333333,"spacegroup":166},{"id":"jvasp-64193","created_at":"2022-09-04T14:38:11.894483Z","updated_at":"2022-09-04T14:38:11.894504Z","structure_string":"Ba4 Li1 Ge1\n1.0\n0.000000 5.044819 5.044819\n5.044819 0.000000 5.044819\n5.044819 5.044819 0.000000\nBa Li Ge\n4 1 1\ndirect\n0.130129 0.623291 0.623291 Ba\n0.623291 0.623291 0.623291 Ba\n0.623291 0.130129 0.623291 Ba\n0.623291 0.623291 0.130129 Ba\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Ge\n","nsites":6,"nelements":3,"elements":["Ba","Li","Ge"],"chemical_system":"Ba-Ge-Li","density":4.06683294512036,"density_atomic":0.023366006196372087,"volume":256.7832923425137,"volume_molar":25.773085521714126,"formula_full":"Ba4 Li1 Ge1","formula_reduced":"Ba4LiGe","formula_anonymous":"ABC4","energy_above_hull":0.1624816383333332,"spacegroup":216},{"id":"jvasp-22458","created_at":"2022-09-04T14:38:32.533292Z","updated_at":"2022-09-04T14:38:32.533300Z","structure_string":"Ba10 Sb6\n1.0\n5.048711 -8.744624 0.000000\n5.048711 8.744624 0.000000\n-0.000000 0.000000 7.754844\nBa Sb\n10 6\ndirect\n0.743375 0.000000 0.250000 Ba\n0.256624 0.000000 0.750000 Ba\n0.743375 0.743375 0.750000 Ba\n0.000000 0.743375 0.250000 Ba\n0.256624 0.256624 0.250000 Ba\n0.000000 0.256624 0.750000 Ba\n0.333333 0.666667 0.500000 Ba\n0.666667 0.333333 0.000000 Ba\n0.666667 0.333333 0.500000 Ba\n0.333333 0.666667 0.000000 Ba\n0.000000 0.389816 0.250000 Sb\n0.389816 0.389816 0.750000 Sb\n0.610183 0.000000 0.750000 Sb\n0.389816 0.000000 0.250000 Sb\n0.610183 0.610183 0.250000 Sb\n0.000000 0.610183 0.750000 Sb\n","nsites":16,"nelements":2,"elements":["Ba","Sb"],"chemical_system":"Ba-Sb","density":5.101936252441848,"density_atomic":0.023366586289857612,"volume":684.7384466658223,"volume_molar":25.772445685033336,"formula_full":"Ba10 Sb6","formula_reduced":"Ba5Sb3","formula_anonymous":"A3B5","energy_above_hull":0.39062976875,"spacegroup":193},{"id":"jvasp-76884","created_at":"2022-09-04T14:37:58.766414Z","updated_at":"2022-09-04T14:37:58.766436Z","structure_string":"Ba2 Mg1 Cd1\n1.0\n-17.743189 -0.000001 -10.244034\n-10.295996 -0.489325 -2.654880\n-9.115726 2.848986 -4.699169\nBa Mg Cd\n2 1 1\ndirect\n0.663344 0.000001 0.000000 Ba\n0.336655 0.000000 0.000000 Ba\n0.000000 0.000000 0.000000 Mg\n0.499999 0.000001 0.000000 Cd\n","nsites":4,"nelements":3,"elements":["Ba","Mg","Cd"],"chemical_system":"Ba-Cd-Mg","density":3.9905045793463088,"density_atomic":0.023367168523278595,"volume":171.18034630576494,"volume_molar":25.771803519971566,"formula_full":"Ba2 Mg1 Cd1","formula_reduced":"Ba2MgCd","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":139},{"id":"jvasp-50007","created_at":"2022-09-04T14:35:49.828075Z","updated_at":"2022-09-04T14:35:49.828101Z","structure_string":"Sr2 Ca4 I12\n1.0\n0.000000 7.186382 0.000000\n-12.454717 3.593191 -1.379834\n0.657333 0.000000 8.679060\nSr Ca I\n2 4 12\ndirect\n0.702616 0.000000 0.750000 Sr\n0.297384 0.000000 0.250000 Sr\n0.404239 0.657733 0.895947 Ca\n0.938027 0.657733 0.395947 Ca\n0.061972 0.342268 0.604053 Ca\n0.595760 0.342267 0.104053 Ca\n0.898676 0.211632 0.317135 I\n0.889692 0.211632 0.817135 I\n0.274292 0.450925 0.380181 I\n0.274782 0.450926 0.880181 I\n0.725217 0.549075 0.119820 I\n0.101324 0.788368 0.682866 I\n0.110307 0.788368 0.182866 I\n0.436250 0.158501 0.532781 I\n0.563750 0.841499 0.467219 I\n0.594749 0.841500 0.967219 I\n0.725707 0.549075 0.619820 I\n0.405250 0.158501 0.032781 I\n","nsites":18,"nelements":3,"elements":["Sr","Ca","I"],"chemical_system":"Ca-I-Sr","density":4.006196353689506,"density_atomic":0.023367654573205998,"volume":770.2955358061181,"volume_molar":25.77126746346702,"formula_full":"Sr2 Ca4 I12","formula_reduced":"SrCa2I6","formula_anonymous":"AB2C6","energy_above_hull":0.0053799999999999,"spacegroup":15},{"id":"jvasp-29527","created_at":"2022-09-04T14:37:50.646619Z","updated_at":"2022-09-04T14:37:50.646639Z","structure_string":"Pb3 I6\n1.0\n4.585485 -0.000000 -0.000000\n-2.292742 3.971146 -0.000000\n-0.000000 -0.000000 21.147016\nPb I\n3 6\ndirect\n0.666667 0.333333 0.666613 Pb\n0.000000 0.000000 0.333094 Pb\n0.000000 0.000000 0.000272 Pb\n0.333333 0.666668 0.422738 I\n0.333333 0.666668 0.089963 I\n0.000000 0.000000 0.576974 I\n0.666667 0.333333 0.910636 I\n0.666667 0.333333 0.243428 I\n0.333333 0.666668 0.756283 I\n","nsites":9,"nelements":2,"elements":["Pb","I"],"chemical_system":"I-Pb","density":5.963887936522761,"density_atomic":0.02337180661378341,"volume":385.0793457572207,"volume_molar":25.766689154652134,"formula_full":"Pb3 I6","formula_reduced":"PbI2","formula_anonymous":"AB2","energy_above_hull":0.0001466666666666,"spacegroup":156},{"id":"jvasp-64367","created_at":"2022-09-04T14:36:21.684225Z","updated_at":"2022-09-04T14:36:21.684248Z","structure_string":"Ba4 Zr1 Zn1\n1.0\n0.000000 5.044275 5.044275\n5.044275 0.000000 5.044275\n5.044275 5.044275 0.000000\nBa Zr Zn\n4 1 1\ndirect\n0.124976 0.625008 0.625008 Ba\n0.625008 0.625008 0.625008 Ba\n0.625008 0.124976 0.625008 Ba\n0.625008 0.625008 0.124976 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Zn\n","nsites":6,"nelements":3,"elements":["Ba","Zr","Zn"],"chemical_system":"Ba-Zn-Zr","density":4.566581809300336,"density_atomic":0.023373566734754655,"volume":256.70023185115656,"volume_molar":25.764748822205004,"formula_full":"Ba4 Zr1 Zn1","formula_reduced":"Ba4ZrZn","formula_anonymous":"ABC4","energy_above_hull":0.45778813,"spacegroup":216},{"id":"jvasp-64816","created_at":"2022-09-04T14:36:04.070950Z","updated_at":"2022-09-04T14:36:04.070971Z","structure_string":"Ba4 Y1 Ti1\n1.0\n0.000000 5.043654 5.043654\n5.043654 0.000000 5.043654\n5.043654 5.043654 -0.000000\nBa Y Ti\n4 1 1\ndirect\n0.126871 0.624376 0.624376 Ba\n0.624376 0.624376 0.624376 Ba\n0.624376 0.126871 0.624376 Ba\n0.624376 0.624376 0.126871 Ba\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Ti\n","nsites":6,"nelements":3,"elements":["Ba","Y","Ti"],"chemical_system":"Ba-Ti-Y","density":4.439750262772225,"density_atomic":0.023382201410432308,"volume":256.6054365318662,"volume_molar":25.755234309602407,"formula_full":"Ba4 Y1 Ti1","formula_reduced":"Ba4YTi","formula_anonymous":"ABC4","energy_above_hull":1.2119412772222222,"spacegroup":216},{"id":"jvasp-115732","created_at":"2022-09-04T14:38:49.246151Z","updated_at":"2022-09-04T14:38:49.246175Z","structure_string":"Rb1 Sn1 Br1\n1.0\n3.722194 -0.000000 -0.000000\n-0.000000 3.722194 0.000000\n0.000000 0.000000 9.260423\nRb Sn Br\n1 1 1\ndirect\n0.000000 0.000000 0.588386 Rb\n0.000000 0.000000 -0.033089 Sn\n0.000000 0.000000 0.252494 Br\n","nsites":3,"nelements":3,"elements":["Rb","Sn","Br"],"chemical_system":"Br-Rb-Sn","density":3.6767463854413345,"density_atomic":0.02338257953828865,"volume":128.3006434378868,"volume_molar":25.754817812717487,"formula_full":"Rb1 Sn1 Br1","formula_reduced":"RbSnBr","formula_anonymous":"ABC","energy_above_hull":0.0668599999999999,"spacegroup":99}]}