{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=582","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=580","results":[{"id":"jvasp-93495","created_at":"2022-09-04T14:36:20.990459Z","updated_at":"2022-09-04T14:36:20.990491Z","structure_string":"Ce2 Sb2 Te2\n1.0\n0.000000 4.382659 -0.000000\n0.000000 -0.000000 4.382707\n9.253771 0.000000 0.000000\nCe Sb Te\n2 2 2\ndirect\n0.250000 0.250000 0.727552 Ce\n0.750000 0.750001 0.272448 Ce\n0.750000 0.250000 -0.000007 Sb\n0.250000 0.750001 0.000007 Sb\n0.250000 0.250000 0.369781 Te\n0.750000 0.750001 0.630219 Te\n","nsites":6,"nelements":3,"elements":["Ce","Sb","Te"],"chemical_system":"Ce-Sb-Te","density":7.277143312939888,"density_atomic":0.03375610926708811,"volume":177.74560310035326,"volume_molar":17.840150689023663,"formula_full":"Ce2 Sb2 Te2","formula_reduced":"CeSbTe","formula_anonymous":"ABC","energy_above_hull":0.9988031222222225,"spacegroup":129},{"id":"jvasp-118125","created_at":"2022-09-04T14:38:50.804327Z","updated_at":"2022-09-04T14:38:50.804340Z","structure_string":"Sr2 P1 Cl1\n1.0\n2.203536 1.272212 7.044329\n-2.203536 1.272212 7.044329\n0.000000 -2.544424 7.044329\nSr P Cl\n2 1 1\ndirect\n0.759716 0.759716 0.759716 Sr\n0.240284 0.240284 0.240284 Sr\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.000000 Cl\n","nsites":4,"nelements":3,"elements":["Sr","P","Cl"],"chemical_system":"Cl-P-Sr","density":3.3868464020336817,"density_atomic":0.033758992099368355,"volume":118.48694973552963,"volume_molar":17.838627238260106,"formula_full":"Sr2 P1 Cl1","formula_reduced":"Sr2PCl","formula_anonymous":"ABC2","energy_above_hull":0.0273255468749999,"spacegroup":166},{"id":"jvasp-28444","created_at":"2022-09-04T14:37:15.347846Z","updated_at":"2022-09-04T14:37:15.347880Z","structure_string":"Hf2 Te6\n1.0\n0.000000 -3.921586 0.000000\n-5.910322 0.000000 0.818210\n-0.019091 0.000000 -10.221509\nHf Te\n2 6\ndirect\n0.750001 0.711799 0.832958 Hf\n0.250000 0.288200 0.167043 Hf\n0.750001 0.569020 0.329416 Te\n0.250000 0.430980 0.670584 Te\n0.750001 0.237016 0.948207 Te\n0.250000 0.762983 0.051793 Te\n0.750001 0.088021 0.334129 Te\n0.250000 0.911979 0.665871 Te\n","nsites":8,"nelements":2,"elements":["Hf","Te"],"chemical_system":"Hf-Te","density":7.8662223575093275,"density_atomic":0.033759018192200674,"volume":236.97371631051269,"volume_molar":17.838613450527692,"formula_full":"Hf2 Te6","formula_reduced":"HfTe3","formula_anonymous":"AB3","energy_above_hull":1.895309075,"spacegroup":11},{"id":"jvasp-115544","created_at":"2022-09-04T14:38:44.864784Z","updated_at":"2022-09-04T14:38:44.864802Z","structure_string":"Ba2 H1 Br1\n1.0\n-0.000000 3.898164 3.898164\n3.898164 -0.000000 3.898164\n3.898164 3.898164 0.000000\nBa H Br\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 H\n0.000000 0.000000 0.000000 Br\n","nsites":4,"nelements":3,"elements":["Ba","H","Br"],"chemical_system":"Ba-Br-H","density":4.9837808315412255,"density_atomic":0.03376367229651184,"volume":118.47052550658847,"volume_molar":17.836154512796153,"formula_full":"Ba2 H1 Br1","formula_reduced":"Ba2HBr","formula_anonymous":"ABC2","energy_above_hull":0.3161565112499999,"spacegroup":225},{"id":"jvasp-18066","created_at":"2022-09-04T14:37:28.439721Z","updated_at":"2022-09-04T14:37:28.439743Z","structure_string":"Th1 Pb3\n1.0\n4.911337 -0.000000 -0.000000\n0.000000 4.911337 -0.000000\n0.000000 0.000000 4.911337\nTh Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Th\n0.000000 0.500000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n0.500000 0.000000 0.500000 Pb\n","nsites":4,"nelements":2,"elements":["Th","Pb"],"chemical_system":"Pb-Th","density":11.965301944599787,"density_atomic":0.03376453602417067,"volume":118.46749492238132,"volume_molar":17.835698247679137,"formula_full":"Th1 Pb3","formula_reduced":"ThPb3","formula_anonymous":"AB3","energy_above_hull":0.967949515,"spacegroup":221},{"id":"jvasp-28863","created_at":"2022-09-04T14:37:40.140767Z","updated_at":"2022-09-04T14:37:40.140789Z","structure_string":"Te2 Mo1 W3 Se6\n1.0\n3.383090 0.000000 0.000000\n-1.691545 2.929847 -0.000274\n0.000000 -0.003357 35.852679\nTe Mo W Se\n2 1 3 6\ndirect\n0.333276 0.666550 0.334163 Te\n0.333291 0.666581 0.229047 Te\n0.666618 0.333234 0.281601 Mo\n0.333022 0.666044 0.087712 W\n0.333395 0.666790 0.475359 W\n0.666999 0.333997 0.658243 W\n0.333753 0.667505 0.704566 Se\n0.666304 0.332606 0.041393 Se\n0.666652 0.333302 0.428958 Se\n0.666393 0.332786 0.134118 Se\n0.666776 0.333549 0.521723 Se\n0.333529 0.667059 0.611866 Se\n","nsites":12,"nelements":4,"elements":["Te","Mo","W","Se"],"chemical_system":"Mo-Se-Te-W","density":6.431613971638332,"density_atomic":0.0337676738186661,"volume":355.3694596921461,"volume_molar":17.834040900593752,"formula_full":"Te2 Mo1 W3 Se6","formula_reduced":"Te2Mo(WSe2)3","formula_anonymous":"AB2C3D6","energy_above_hull":4.025387636111112,"spacegroup":156},{"id":"jvasp-118880","created_at":"2022-09-04T14:38:50.700154Z","updated_at":"2022-09-04T14:38:50.700179Z","structure_string":"As2 I2\n1.0\n4.369130 0.000000 0.000000\n0.000000 4.369130 0.000000\n0.000000 0.000000 6.205115\nAs I\n2 2\ndirect\n0.000000 0.000000 0.250009 As\n0.500000 0.500000 0.749990 As\n0.000000 0.000000 0.750023 I\n0.500000 0.500000 0.249977 I\n","nsites":4,"nelements":2,"elements":["As","I"],"chemical_system":"As-I","density":5.658698930493988,"density_atomic":0.03376915726464148,"volume":118.45128288671455,"volume_molar":17.83325746865935,"formula_full":"As2 I2","formula_reduced":"AsI","formula_anonymous":"AB","energy_above_hull":0.9036390125,"spacegroup":225},{"id":"jvasp-10018","created_at":"2022-09-04T14:38:19.205931Z","updated_at":"2022-09-04T14:38:19.205956Z","structure_string":"K4 Si2 As4\n1.0\n5.892831 0.000000 -2.510670\n-1.283723 6.144994 -3.013044\n-0.008131 0.050074 8.151825\nK Si As\n4 2 4\ndirect\n0.856346 0.018339 0.712693 K\n0.356347 0.694353 0.712694 K\n0.643653 0.305646 0.287307 K\n0.143654 0.981660 0.287307 K\n0.250000 0.500000 0.000000 Si\n0.750000 0.500000 0.000000 Si\n0.602379 0.772262 0.204759 As\n0.102379 0.432496 0.204759 As\n0.897621 0.567503 0.795242 As\n0.397621 0.227737 0.795242 As\n","nsites":10,"nelements":3,"elements":["K","Si","As"],"chemical_system":"As-K-Si","density":2.8725822227682025,"density_atomic":0.03377076473148492,"volume":296.11411170315813,"volume_molar":17.832408616987816,"formula_full":"K4 Si2 As4","formula_reduced":"K2SiAs2","formula_anonymous":"AB2C2","energy_above_hull":1.1610436199999996,"spacegroup":72},{"id":"jvasp-38380","created_at":"2022-09-04T14:37:54.488662Z","updated_at":"2022-09-04T14:37:54.488689Z","structure_string":"Pr6 Cl2\n1.0\n3.431565 -5.943646 -0.000000\n3.431565 5.943646 -0.000000\n0.000000 0.000000 5.807024\nPr Cl\n6 2\ndirect\n0.168101 0.831901 0.749999 Pr\n0.663800 0.831901 0.749999 Pr\n0.168100 0.336201 0.749999 Pr\n0.831901 0.168101 0.250000 Pr\n0.336201 0.168100 0.250000 Pr\n0.831901 0.663800 0.250000 Pr\n0.333334 0.666668 0.250000 Cl\n0.666668 0.333334 0.749999 Cl\n","nsites":8,"nelements":2,"elements":["Pr","Cl"],"chemical_system":"Cl-Pr","density":6.423660809654344,"density_atomic":0.03377234409933779,"volume":236.88021111205202,"volume_molar":17.831574682191167,"formula_full":"Pr6 Cl2","formula_reduced":"Pr3Cl","formula_anonymous":"AB3","energy_above_hull":1.2732882333333335,"spacegroup":194},{"id":"jvasp-78756","created_at":"2022-09-04T14:36:34.250711Z","updated_at":"2022-09-04T14:36:34.250732Z","structure_string":"Yb1 Mg1\n1.0\n3.893471 0.000000 0.000000\n0.000000 2.757636 2.757621\n0.000000 -2.757636 2.757621\nYb Mg\n1 1\ndirect\n0.500000 0.416667 0.583333 Yb\n0.000000 0.916666 0.083331 Mg\n","nsites":2,"nelements":2,"elements":["Yb","Mg"],"chemical_system":"Mg-Yb","density":5.533969577264002,"density_atomic":0.03377470294900645,"volume":59.215916806718624,"volume_molar":17.830329312125464,"formula_full":"Yb1 Mg1","formula_reduced":"YbMg","formula_anonymous":"AB","energy_above_hull":0.2804421428571428,"spacegroup":221},{"id":"jvasp-29967","created_at":"2022-09-04T14:37:58.209823Z","updated_at":"2022-09-04T14:37:58.209849Z","structure_string":"Bi2 Pb1 Se4\n1.0\n4.186203 -0.001530 12.864167\n2.039172 3.655965 12.864167\n-0.002607 -0.001530 13.528159\nBi Pb Se\n2 1 4\ndirect\n0.428204 0.428204 0.428206 Bi\n0.571794 0.571794 0.571797 Bi\n0.000000 0.000000 0.000000 Pb\n0.133394 0.133394 0.133394 Se\n0.286852 0.286852 0.286854 Se\n0.713146 0.713146 0.713149 Se\n0.866605 0.866605 0.866609 Se\n","nsites":7,"nelements":3,"elements":["Bi","Pb","Se"],"chemical_system":"Bi-Pb-Se","density":7.539522225604807,"density_atomic":0.03377557690174324,"volume":207.25034602262303,"volume_molar":17.82986794724203,"formula_full":"Bi2 Pb1 Se4","formula_reduced":"Bi2PbSe4","formula_anonymous":"AB2C4","energy_above_hull":1.175751840952381,"spacegroup":166},{"id":"jvasp-107819","created_at":"2022-09-04T14:38:17.881453Z","updated_at":"2022-09-04T14:38:17.881478Z","structure_string":"K2 Ag1 Sb1 Cl6\n1.0\n6.478854 -0.000000 3.740568\n2.159618 6.108322 3.740568\n-0.000000 -0.000000 7.481136\nK Ag Sb Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500001 Ag\n0.000000 0.000000 0.000000 Sb\n0.750098 0.249901 0.249902 Cl\n0.249902 0.249901 0.750099 Cl\n0.249902 0.750098 0.750099 Cl\n0.249902 0.750098 0.249902 Cl\n0.750098 0.249901 0.750099 Cl\n0.750098 0.750098 0.249902 Cl\n","nsites":10,"nelements":4,"elements":["K","Ag","Sb","Cl"],"chemical_system":"Ag-Cl-K-Sb","density":2.919563162395986,"density_atomic":0.03377632027133088,"volume":296.0654067603668,"volume_molar":17.829475536775842,"formula_full":"K2 Ag1 Sb1 Cl6","formula_reduced":"K2AgSbCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225}]}