{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=555","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=553","results":[{"id":"jvasp-9896","created_at":"2022-09-04T14:38:18.128703Z","updated_at":"2022-09-04T14:38:18.128714Z","structure_string":"Ti1 Zn2 W1 O6\n1.0\n5.222283 0.363922 0.223446\n2.301970 4.706805 -0.037705\n2.301774 1.827745 4.653864\nTi Zn W O\n1 2 1 6\ndirect\n0.522242 0.482193 0.493569 Ti\n0.252714 0.212661 0.302180 Zn\n0.770210 0.730144 0.749681 Zn\n0.020751 -0.019299 -0.001946 W\n0.900843 0.607776 0.241877 O\n0.142932 0.355181 0.740835 O\n0.647851 0.229731 0.241861 O\n0.781271 0.102881 0.740862 O\n0.269808 0.860771 0.241872 O\n0.395226 0.741261 0.740858 O\n","nsites":10,"nelements":4,"elements":["Ti","Zn","W","O"],"chemical_system":"O-Ti-W-Zn","density":6.963397197830743,"density_atomic":0.09145605441233058,"volume":109.34213228699868,"volume_molar":6.584737116308467,"formula_full":"Ti1 Zn2 W1 O6","formula_reduced":"TiZn2WO6","formula_anonymous":"ABC2D6","energy_above_hull":2.550191013333333,"spacegroup":146},{"id":"jvasp-100511","created_at":"2022-09-04T14:37:01.585078Z","updated_at":"2022-09-04T14:37:01.585098Z","structure_string":"Ti1 Zn2 Pd1\n1.0\n3.783806 -0.000000 2.184582\n1.261269 3.567407 2.184582\n0.000000 -0.000000 4.369163\nTi Zn Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.249999 Zn\n0.750001 0.750001 0.749998 Zn\n0.500000 0.500000 0.499999 Pd\n","nsites":4,"nelements":3,"elements":["Ti","Zn","Pd"],"chemical_system":"Pd-Ti-Zn","density":8.027386289224017,"density_atomic":0.06782350388145711,"volume":58.9766050275323,"volume_molar":8.879135425568078,"formula_full":"Ti1 Zn2 Pd1","formula_reduced":"TiZn2Pd","formula_anonymous":"ABC2","energy_above_hull":0.4916162083333334,"spacegroup":225},{"id":"jvasp-58166","created_at":"2022-09-04T14:37:05.838004Z","updated_at":"2022-09-04T14:37:05.838024Z","structure_string":"Ti2 Zn4 Ir2 O12\n1.0\n0.000000 5.216214 0.002027\n5.226876 0.000000 0.000000\n0.000000 -5.178035 -7.630239\nTi Zn Ir O\n2 4 2 12\ndirect\n0.000000 0.500000 0.000000 Ti\n-0.000000 0.000000 0.500000 Ti\n0.259828 0.970313 0.251027 Zn\n0.740171 0.470313 0.248973 Zn\n0.259827 0.529688 0.751027 Zn\n0.740170 0.029687 0.748973 Zn\n0.499999 0.500000 0.500000 Ir\n0.499999 0.000000 -0.000000 Ir\n0.105812 0.819479 0.934365 O\n0.262913 0.327309 0.939761 O\n0.894186 0.319479 0.565635 O\n0.634053 0.081497 0.250492 O\n0.365945 0.918504 0.749507 O\n0.894186 0.180521 0.065635 O\n0.737085 0.672692 0.060239 O\n0.262914 0.172691 0.439761 O\n0.737084 0.827310 0.560239 O\n0.634052 0.418504 0.750492 O\n0.105812 0.680522 0.434365 O\n0.365946 0.581497 0.249507 O\n","nsites":20,"nelements":4,"elements":["Ti","Zn","Ir","O"],"chemical_system":"Ir-O-Ti-Zn","density":7.455560216247226,"density_atomic":0.09616317614798586,"volume":207.979819314848,"volume_molar":6.262418735766906,"formula_full":"Ti2 Zn4 Ir2 O12","formula_reduced":"TiZn2IrO6","formula_anonymous":"ABC2D6","energy_above_hull":2.190034123333333,"spacegroup":14},{"id":"jvasp-30932","created_at":"2022-09-04T14:36:42.490268Z","updated_at":"2022-09-04T14:36:42.490286Z","structure_string":"Ti4 Zn8\n1.0\n2.539919 -4.399270 -0.000000\n2.539919 4.399270 0.000000\n0.000000 -0.000000 8.126123\nTi Zn\n4 8\ndirect\n0.333333 0.666667 0.931790 Ti\n0.666667 0.333333 0.431790 Ti\n0.666667 0.333333 0.068209 Ti\n0.333333 0.666667 0.568209 Ti\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.344506 0.172254 0.750000 Zn\n0.172254 0.827747 0.250000 Zn\n0.172254 0.344506 0.250000 Zn\n0.827747 0.655494 0.750000 Zn\n0.827747 0.172254 0.750000 Zn\n0.655494 0.827747 0.250000 Zn\n","nsites":12,"nelements":2,"elements":["Ti","Zn"],"chemical_system":"Ti-Zn","density":6.53556764334018,"density_atomic":0.0660795953353063,"volume":181.59917504198765,"volume_molar":9.113464950022738,"formula_full":"Ti4 Zn8","formula_reduced":"TiZn2","formula_anonymous":"AB2","energy_above_hull":0.384978703703704,"spacegroup":194},{"id":"jvasp-36527","created_at":"2022-09-04T14:37:39.961195Z","updated_at":"2022-09-04T14:37:39.961221Z","structure_string":"Ti1 Zn1\n1.0\n3.139769 0.000000 -0.000000\n0.000000 3.139769 0.000000\n-0.000000 -0.000000 3.139769\nTi Zn\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Zn\n","nsites":2,"nelements":2,"elements":["Ti","Zn"],"chemical_system":"Ti-Zn","density":6.077065407085477,"density_atomic":0.06461552897673392,"volume":30.952311799848285,"volume_molar":9.319958925304766,"formula_full":"Ti1 Zn1","formula_reduced":"TiZn","formula_anonymous":"AB","energy_above_hull":0.8357611111111114,"spacegroup":221},{"id":"jvasp-30720","created_at":"2022-09-04T14:38:14.032926Z","updated_at":"2022-09-04T14:38:14.032946Z","structure_string":"Ti1 W2 O8\n1.0\n4.232853 -0.155820 -2.438879\n-0.971162 6.018139 -1.977573\n-0.576057 0.025755 6.128545\nTi W O\n1 2 8\ndirect\n0.124697 0.223239 0.099693 Ti\n0.915306 0.418630 0.632205 W\n0.334088 0.027852 0.567181 W\n0.215489 0.666526 0.839655 O\n0.520573 0.482734 0.363021 O\n0.209443 0.187383 0.813655 O\n0.449803 0.064428 0.330532 O\n0.728814 0.963742 0.836362 O\n0.033898 0.779959 0.359731 O\n0.039957 0.259098 0.385734 O\n0.799589 0.382044 0.868852 O\n","nsites":11,"nelements":3,"elements":["Ti","W","O"],"chemical_system":"O-Ti-W","density":6.146872587113814,"density_atomic":0.07491426638593078,"volume":146.8345153823177,"volume_molar":8.03871018235184,"formula_full":"Ti1 W2 O8","formula_reduced":"Ti(WO4)2","formula_anonymous":"AB2C8","energy_above_hull":4.066289666666666,"spacegroup":2},{"id":"jvasp-105971","created_at":"2022-09-04T14:36:09.410036Z","updated_at":"2022-09-04T14:36:09.410064Z","structure_string":"Ti1 W1\n1.0\n2.776868 0.002428 0.000000\n-0.969745 2.602037 0.000000\n0.000000 0.000000 4.443702\nTi W\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500001 0.500000 W\n","nsites":2,"nelements":2,"elements":["Ti","W"],"chemical_system":"Ti-W","density":11.979346389487617,"density_atomic":0.062269426642460275,"volume":32.11849069180669,"volume_molar":9.671103597240485,"formula_full":"Ti1 W1","formula_reduced":"TiW","formula_anonymous":"AB","energy_above_hull":4.021344166666666,"spacegroup":65},{"id":"jvasp-51159","created_at":"2022-09-04T14:36:49.591202Z","updated_at":"2022-09-04T14:36:49.591223Z","structure_string":"Ti1 V1 W1\n1.0\n0.000000 2.975965 2.975965\n2.975965 -0.000000 2.975965\n2.975965 2.975965 0.000000\nTi V W\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 V\n0.500001 0.500001 0.500001 W\n","nsites":3,"nelements":3,"elements":["Ti","V","W"],"chemical_system":"Ti-V-W","density":8.903942140021046,"density_atomic":0.05691251809717643,"volume":52.712480492913514,"volume_molar":10.581399244569312,"formula_full":"Ti1 V1 W1","formula_reduced":"TiVW","formula_anonymous":"ABC","energy_above_hull":5.1079341777777785,"spacegroup":216},{"id":"jvasp-35459","created_at":"2022-09-04T14:37:34.025136Z","updated_at":"2022-09-04T14:37:34.025157Z","structure_string":"Ti1 V2 Te4\n1.0\n0.000000 4.019065 0.000000\n-0.088355 0.000000 7.050999\n6.056923 -2.009533 -3.469803\nTi V Te\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Ti\n0.245518 0.269211 0.491033 V\n0.754484 0.730789 0.508967 V\n0.117643 0.459109 0.235287 Te\n0.882359 0.540892 0.764713 Te\n0.368510 0.041679 0.737017 Te\n0.631492 0.958322 0.262983 Te\n","nsites":7,"nelements":3,"elements":["Ti","V","Te"],"chemical_system":"Te-Ti-V","density":6.432692812358788,"density_atomic":0.04107703872858666,"volume":170.41150522684842,"volume_molar":14.660601022850813,"formula_full":"Ti1 V2 Te4","formula_reduced":"Ti(VTe2)2","formula_anonymous":"AB2C4","energy_above_hull":2.577308257142857,"spacegroup":12},{"id":"jvasp-39838","created_at":"2022-09-04T14:37:49.560170Z","updated_at":"2022-09-04T14:37:49.560179Z","structure_string":"Ti1 V1 Tc2\n1.0\n0.000000 3.058412 3.058412\n3.058412 0.000000 3.058412\n3.058412 3.058412 -0.000000\nTi V Tc\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Ti\n0.749999 0.749999 0.749999 V\n0.000000 0.000000 0.000000 Tc\n0.499999 0.499999 0.499999 Tc\n","nsites":4,"nelements":3,"elements":["Ti","V","Tc"],"chemical_system":"Tc-Ti-V","density":8.556007090845782,"density_atomic":0.06991043889499457,"volume":57.216061910410794,"volume_molar":8.614079463934207,"formula_full":"Ti1 V1 Tc2","formula_reduced":"TiVTc2","formula_anonymous":"ABC2","energy_above_hull":4.656611383333334,"spacegroup":225},{"id":"jvasp-102659","created_at":"2022-09-04T14:36:46.440377Z","updated_at":"2022-09-04T14:36:46.440393Z","structure_string":"Ti1 V1 Se4\n1.0\n3.469525 0.000000 0.000000\n0.000000 6.021638 0.018710\n-0.000000 -0.003245 6.104951\nTi V Se\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500001 0.500000 -0.000000 V\n-0.000000 0.662476 0.747011 Se\n0.500001 0.170388 0.743393 Se\n0.500001 0.829613 0.256607 Se\n-0.000000 0.337525 0.252989 Se\n","nsites":6,"nelements":3,"elements":["Ti","V","Se"],"chemical_system":"Se-Ti-V","density":5.398357371137542,"density_atomic":0.04704177341484437,"volume":127.54621189741663,"volume_molar":12.801687357517158,"formula_full":"Ti1 V1 Se4","formula_reduced":"TiVSe4","formula_anonymous":"ABC4","energy_above_hull":2.385862666666667,"spacegroup":10},{"id":"jvasp-106709","created_at":"2022-09-04T14:36:59.383828Z","updated_at":"2022-09-04T14:36:59.383851Z","structure_string":"Ti2 V2 S4\n1.0\n3.323915 -0.000000 0.000000\n0.000000 5.844953 0.000000\n0.000000 -0.000000 6.002403\nTi V S\n2 2 4\ndirect\n-0.000000 0.058349 0.509026 Ti\n-0.000000 0.941651 0.009026 Ti\n0.500001 0.442349 0.485943 V\n0.500001 0.557651 0.985942 V\n-0.000000 0.663799 0.719719 S\n-0.000000 0.336201 0.219719 S\n0.500001 0.822165 0.285312 S\n0.500001 0.177834 0.785311 S\n","nsites":8,"nelements":3,"elements":["Ti","V","S"],"chemical_system":"S-Ti-V","density":4.6403071036489845,"density_atomic":0.06860154612313027,"volume":116.61544749503325,"volume_molar":8.778432995068496,"formula_full":"Ti2 V2 S4","formula_reduced":"TiVS2","formula_anonymous":"ABC2","energy_above_hull":2.6720806333333336,"spacegroup":26}]}