{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4583","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4581","results":[{"id":"jvasp-29153","created_at":"2022-09-04T14:37:43.008842Z","updated_at":"2022-09-04T14:37:43.008864Z","structure_string":"Te2 Mo2 W2 Se2 S4\n1.0\n3.312465 0.000000 0.000000\n-1.656232 2.868696 -0.000007\n0.000000 -0.000102 37.447098\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.333360 0.666719 0.708872 Te\n0.333360 0.666720 0.606029 Te\n0.333312 0.666624 0.093988 Mo\n0.333265 0.666529 0.469620 Mo\n0.666693 0.333386 0.281789 W\n0.666695 0.333393 0.657479 W\n0.666638 0.333275 0.049240 Se\n0.666648 0.333296 0.138819 Se\n0.333364 0.666729 0.322876 S\n0.666655 0.333311 0.428819 S\n0.666655 0.333311 0.510465 S\n0.333358 0.666719 0.240751 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":5.137581865502585,"density_atomic":0.033723081552969526,"volume":355.83936720466534,"volume_molar":17.857622977131854,"formula_full":"Te2 Mo2 W2 Se2 S4","formula_reduced":"TeMoWSeS2","formula_anonymous":"ABCDE2","energy_above_hull":3.6154378388888886,"spacegroup":156},{"id":"jvasp-43954","created_at":"2022-09-04T14:37:30.054222Z","updated_at":"2022-09-04T14:37:30.054246Z","structure_string":"Li4 Mn2 Fe2 B4 O12\n1.0\n5.184924 0.001166 0.050898\n-2.582740 4.482678 0.069462\n-0.078738 -0.065244 10.119584\nLi Mn Fe B O\n4 2 2 4 12\ndirect\n0.685567 0.664483 0.662657 Li\n0.631696 0.650824 0.167990 Li\n0.374215 0.359988 0.416110 Li\n0.322308 0.332168 0.919489 Li\n0.650494 -0.008935 0.884247 Mn\n0.014177 0.341822 0.632457 Mn\n0.296522 -0.031159 0.146995 Fe\n0.039430 0.700955 0.365857 Fe\n0.347884 0.010933 0.621893 B\n-0.010858 0.658208 0.880334 B\n0.972790 0.309422 0.128706 B\n0.700313 0.028436 0.374759 B\n0.232023 0.923527 0.920685 O\n0.964198 0.282544 0.407019 O\n0.713994 0.041894 0.102421 O\n0.947299 0.558582 0.157659 O\n0.447902 0.055123 0.351878 O\n0.714150 0.634281 0.863667 O\n0.681321 0.754261 0.361304 O\n0.377356 0.290640 0.610446 O\n0.248221 0.329298 0.123031 O\n0.587866 0.979318 0.661735 O\n0.024690 0.413704 0.851182 O\n0.077041 0.760305 0.591276 O\n","nsites":24,"nelements":5,"elements":["Li","Mn","Fe","B","O"],"chemical_system":"B-Fe-Li-Mn-O","density":3.4198858082506667,"density_atomic":0.1020046601740986,"volume":235.2833680249265,"volume_molar":5.903789836387461,"formula_full":"Li4 Mn2 Fe2 B4 O12","formula_reduced":"Li2MnFe(BO3)2","formula_anonymous":"ABC2D2E6","energy_above_hull":3.1267832423371646,"spacegroup":1},{"id":"jvasp-41550","created_at":"2022-09-04T14:37:48.310948Z","updated_at":"2022-09-04T14:37:48.310975Z","structure_string":"K1 Sr1 C1 O3 F1\n1.0\n2.635631 -4.565046 -0.000000\n2.635631 4.565046 0.000000\n-0.000000 0.000000 4.718368\nK Sr C O F\n1 1 1 3 1\ndirect\n0.000000 0.000000 0.000000 K\n0.666667 0.333333 0.500000 Sr\n0.333333 0.666667 0.500000 C\n0.190947 0.381894 0.500000 O\n0.190947 0.809053 0.500000 O\n0.618106 0.809052 0.500000 O\n0.666667 0.333333 0.000000 F\n","nsites":7,"nelements":5,"elements":["K","Sr","C","O","F"],"chemical_system":"C-F-K-O-Sr","density":3.008748392339239,"density_atomic":0.061651900580970226,"volume":113.5407008386803,"volume_molar":9.767972606279754,"formula_full":"K1 Sr1 C1 O3 F1","formula_reduced":"KSrCO3F","formula_anonymous":"ABCDE3","energy_above_hull":1.5285907275000006,"spacegroup":187},{"id":"jvasp-28995","created_at":"2022-09-04T14:37:42.957347Z","updated_at":"2022-09-04T14:37:42.957364Z","structure_string":"Te2 Mo1 W3 Se4 S2\n1.0\n3.351036 0.000005 0.000004\n-1.675514 2.902043 0.000001\n0.000046 0.000031 37.873956\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.666646 0.333288 0.043984 Te\n0.666643 0.333283 0.144079 Te\n0.333316 0.666626 0.093884 Mo\n0.333317 0.666629 0.469669 W\n0.666686 0.333365 0.281820 W\n0.666688 0.333371 0.657513 W\n0.333358 0.666712 0.701557 Se\n0.666645 0.333287 0.425427 Se\n0.666640 0.333279 0.513895 Se\n0.333364 0.666725 0.613305 Se\n0.333351 0.666705 0.322084 S\n0.333355 0.666711 0.241531 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":5.782644713761526,"density_atomic":0.03258046399355344,"volume":368.3188797548859,"volume_molar":18.48390115374531,"formula_full":"Te2 Mo1 W3 Se4 S2","formula_reduced":"Te2MoW3(Se2S)2","formula_anonymous":"AB2C2D3E4","energy_above_hull":4.122961241666667,"spacegroup":156},{"id":"jvasp-28931","created_at":"2022-09-04T14:37:38.174000Z","updated_at":"2022-09-04T14:37:38.174013Z","structure_string":"Te2 Mo1 W3 Se4 S2\n1.0\n3.344920 0.000004 -0.000045\n-1.672457 2.896778 0.000045\n-0.000505 0.000263 35.149371\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333416 0.666733 0.331471 Te\n0.333386 0.666758 0.223261 Te\n0.666737 0.333412 0.277385 Mo\n0.333259 0.666744 0.085458 W\n0.333256 0.666443 0.476189 W\n0.666756 0.333416 0.663904 W\n0.333400 0.666685 0.711528 Se\n0.666579 0.333104 0.428490 Se\n0.666606 0.333120 0.523862 Se\n0.333434 0.666798 0.616227 Se\n0.666578 0.333402 0.042098 S\n0.666578 0.333378 0.128877 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":6.253622836253596,"density_atomic":0.03523403973980101,"volume":340.57973733975734,"volume_molar":17.091825985532058,"formula_full":"Te2 Mo1 W3 Se4 S2","formula_reduced":"Te2MoW3(Se2S)2","formula_anonymous":"AB2C2D3E4","energy_above_hull":4.122125408333334,"spacegroup":156},{"id":"jvasp-41787","created_at":"2022-09-04T14:37:28.723196Z","updated_at":"2022-09-04T14:37:28.723229Z","structure_string":"K2 Na2 Pr2 Ta2 O10\n1.0\n5.792268 0.000000 0.000000\n0.000000 5.792268 0.000000\n-0.000000 0.000000 8.289053\nK Na Pr Ta O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.241299 Na\n0.000000 0.500000 0.758701 Na\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.500000 Pr\n0.000000 0.500000 0.255320 Ta\n0.500000 0.000000 0.744680 Ta\n0.269905 0.230095 0.674048 O\n0.730095 0.769905 0.674048 O\n0.269905 0.769905 0.674048 O\n0.230095 0.730095 0.325951 O\n0.000000 0.500000 0.031184 O\n0.230095 0.269905 0.325951 O\n0.769905 0.269905 0.325951 O\n0.730095 0.230095 0.674048 O\n0.769905 0.730095 0.325951 O\n0.500000 0.000000 0.968816 O\n","nsites":18,"nelements":5,"elements":["K","Na","Pr","Ta","O"],"chemical_system":"K-Na-O-Pr-Ta","density":5.540376264863863,"density_atomic":0.06472473677517099,"volume":278.10078336085206,"volume_molar":9.304233682585094,"formula_full":"K2 Na2 Pr2 Ta2 O10","formula_reduced":"KNaPrTaO5","formula_anonymous":"ABCDE5","energy_above_hull":2.1488581722222224,"spacegroup":129},{"id":"jvasp-35164","created_at":"2022-09-04T14:37:30.115888Z","updated_at":"2022-09-04T14:37:30.115925Z","structure_string":"Li4 Ca2 Mg1 Si2 N6\n1.0\n-0.022028 0.000000 -5.621906\n-2.930408 -4.903149 0.241172\n-2.930408 4.903149 0.241172\nLi Ca Mg Si N\n4 2 1 2 6\ndirect\n0.625653 0.988358 0.332416 Li\n0.625653 0.332416 0.988358 Li\n0.374349 0.011643 0.667585 Li\n0.374349 0.667585 0.011643 Li\n0.000000 0.322235 0.677765 Ca\n0.000000 0.677765 0.322235 Ca\n0.000000 0.000000 0.000000 Mg\n0.367998 0.319813 0.319813 Si\n0.632003 0.680188 0.680188 Si\n0.311345 0.623190 0.623190 N\n0.688656 0.376811 0.376811 N\n0.253009 0.031066 0.320787 N\n0.253009 0.320787 0.031066 N\n0.746992 0.968935 0.679214 N\n0.746992 0.679214 0.968935 N\n","nsites":15,"nelements":5,"elements":["Li","Ca","Mg","Si","N"],"chemical_system":"Ca-Li-Mg-N-Si","density":2.799349534155022,"density_atomic":0.0928184852285476,"volume":161.6057400965486,"volume_molar":6.488083429902612,"formula_full":"Li4 Ca2 Mg1 Si2 N6","formula_reduced":"Li4Ca2Mg(SiN3)2","formula_anonymous":"AB2C2D4E6","energy_above_hull":3.091970439333333,"spacegroup":12},{"id":"jvasp-59627","created_at":"2022-09-04T14:37:33.258678Z","updated_at":"2022-09-04T14:37:33.258703Z","structure_string":"Sr2 Sm1 Ta1 Cu2 O8\n1.0\n3.934879 -0.000000 0.000000\n-0.000000 3.934879 -0.000000\n-0.000000 -0.000000 11.653601\nSr Sm Ta Cu O\n2 1 1 2 8\ndirect\n0.500000 0.500000 0.799512 Sr\n0.500000 0.500000 0.200488 Sr\n0.500000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.640322 Cu\n0.000000 0.000000 0.359678 Cu\n0.500000 0.000000 0.628689 O\n0.000000 0.500000 0.628689 O\n0.500000 0.000000 0.371311 O\n0.000000 0.500000 0.371311 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.169713 O\n0.000000 0.000000 0.830287 O\n","nsites":14,"nelements":5,"elements":["Sr","Sm","Ta","Cu","O"],"chemical_system":"Cu-O-Sm-Sr-Ta","density":7.009275459105205,"density_atomic":0.07758988837135136,"volume":180.4358827402211,"volume_molar":7.761502028689042,"formula_full":"Sr2 Sm1 Ta1 Cu2 O8","formula_reduced":"Sr2SmTa(CuO4)2","formula_anonymous":"ABC2D2E8","energy_above_hull":2.0692949710714283,"spacegroup":123},{"id":"jvasp-22922","created_at":"2022-09-04T14:37:30.883792Z","updated_at":"2022-09-04T14:37:30.883809Z","structure_string":"Be6 Cd8 Si6 S2 O24\n1.0\n8.535075 -0.000000 0.000000\n0.000000 8.535075 0.000000\n0.000000 0.000000 8.535075\nBe Cd Si S O\n6 8 6 2 24\ndirect\n0.250000 0.500000 0.000000 Be\n0.500000 0.000000 0.750000 Be\n0.500000 0.000000 0.250000 Be\n0.000000 0.250000 0.500000 Be\n0.000000 0.750000 0.500000 Be\n0.750000 0.500000 0.000000 Be\n0.330039 0.330039 0.669961 Cd\n0.169961 0.169961 0.169961 Cd\n0.669961 0.669961 0.669961 Cd\n0.830039 0.169961 0.830039 Cd\n0.830039 0.830039 0.169961 Cd\n0.669961 0.330039 0.330039 Cd\n0.330039 0.669961 0.330039 Cd\n0.169961 0.830039 0.830039 Cd\n0.000000 0.500000 0.250000 Si\n0.000000 0.500000 0.750000 Si\n0.250000 0.000000 0.500000 Si\n0.500000 0.250000 0.000000 Si\n0.500000 0.750000 0.000000 Si\n0.750000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.500000 S\n0.356277 0.643434 0.072135 O\n0.356566 0.072135 0.643724 O\n0.072135 0.356277 0.643434 O\n0.072135 0.643724 0.356566 O\n0.643434 0.927866 0.643724 O\n0.927866 0.643724 0.643434 O\n0.643434 0.072135 0.356277 O\n0.356566 0.927866 0.356277 O\n0.927866 0.356277 0.356566 O\n0.143434 0.856277 0.572135 O\n0.856567 0.143723 0.572135 O\n0.856277 0.427865 0.856567 O\n0.572135 0.143434 0.856277 O\n0.143723 0.572135 0.856567 O\n0.143723 0.427865 0.143434 O\n0.356277 0.356566 0.927866 O\n0.143434 0.143723 0.427865 O\n0.856567 0.856277 0.427865 O\n0.572135 0.856567 0.143723 O\n0.427865 0.856567 0.856277 O\n0.856277 0.572135 0.143434 O\n0.643724 0.356566 0.072135 O\n0.427865 0.143434 0.143723 O\n0.643724 0.643434 0.927866 O\n","nsites":46,"nelements":5,"elements":["Be","Cd","Si","S","O"],"chemical_system":"Be-Cd-O-S-Si","density":4.192990450171913,"density_atomic":0.07398365902327651,"volume":621.7589209196536,"volume_molar":8.13982552296492,"formula_full":"Be6 Cd8 Si6 S2 O24","formula_reduced":"Be3Cd4Si3SO12","formula_anonymous":"AB3C3D4E12","energy_above_hull":2.00836065652174,"spacegroup":218},{"id":"jvasp-45745","created_at":"2022-09-04T14:37:33.570827Z","updated_at":"2022-09-04T14:37:33.570848Z","structure_string":"Na4 In2 P2 C2 O14\n1.0\n0.000000 5.220797 -0.031242\n6.768189 0.000000 0.000000\n0.000000 -0.014234 -9.122734\nNa In P C O\n4 2 2 2 14\ndirect\n0.229512 0.496528 0.214771 Na\n0.229512 0.003472 0.214771 Na\n0.770489 0.503472 0.785228 Na\n0.770489 0.996528 0.785228 Na\n0.779580 0.750000 0.365491 In\n0.220421 0.250000 0.634509 In\n0.715763 0.250000 0.419494 P\n0.284238 0.750000 0.580506 P\n0.716719 0.750000 0.076479 C\n0.283282 0.250000 0.923520 C\n0.472349 0.250000 0.824843 O\n0.187020 0.933863 0.663086 O\n0.187020 0.566138 0.663086 O\n0.815536 0.250000 0.580331 O\n0.585349 0.750000 0.573120 O\n0.414652 0.250000 0.426879 O\n0.946928 0.750000 0.132404 O\n0.812982 0.433863 0.336913 O\n0.812982 0.066137 0.336913 O\n0.527652 0.750000 0.175156 O\n0.053074 0.250000 0.867596 O\n0.328727 0.250000 0.058840 O\n0.184465 0.750000 0.419668 O\n0.671274 0.750000 0.941160 O\n","nsites":24,"nelements":5,"elements":["Na","In","P","C","O"],"chemical_system":"C-In-Na-O-P","density":3.2532866952268247,"density_atomic":0.0744514036768297,"volume":322.3579249650753,"volume_molar":8.088686663505005,"formula_full":"Na4 In2 P2 C2 O14","formula_reduced":"Na2InPCO7","formula_anonymous":"ABCD2E7","energy_above_hull":2.2705398308333327,"spacegroup":11},{"id":"jvasp-28533","created_at":"2022-09-04T14:37:30.112657Z","updated_at":"2022-09-04T14:37:30.112689Z","structure_string":"Te2 Mo2 W1 Se2 S2\n1.0\n3.360012 0.000537 -0.000087\n-1.680452 2.906258 0.139526\n0.000745 0.990814 20.107038\nTe Mo W Se S\n2 2 1 2 2\ndirect\n0.589320 0.179151 0.579822 Te\n0.525341 0.051235 0.770197 Te\n0.439740 0.879400 0.025213 Mo\n0.669587 0.338715 0.340689 Mo\n0.223963 0.448485 0.675087 W\n0.800943 0.601783 0.942237 Se\n0.745207 0.490330 0.108180 Se\n0.310870 0.621304 0.416262 S\n0.361627 0.722796 0.265156 S\n","nsites":9,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":7.230159081856784,"density_atomic":0.04594174724886303,"volume":195.9002549739275,"volume_molar":13.10821011525424,"formula_full":"Te2 Mo2 W1 Se2 S2","formula_reduced":"Te2Mo2W(SeS)2","formula_anonymous":"AB2C2D2E2","energy_above_hull":3.666584896296296,"spacegroup":160},{"id":"jvasp-29079","created_at":"2022-09-04T14:37:33.529510Z","updated_at":"2022-09-04T14:37:33.529537Z","structure_string":"Te4 Mo2 W2 Se2 S2\n1.0\n3.401285 -0.000000 -0.000000\n-1.700643 2.945597 -0.000001\n-0.000000 -0.000003 36.556751\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.333336 0.666670 0.339235 Te\n0.666702 0.333401 0.036479 Te\n0.666700 0.333396 0.139141 Te\n0.333350 0.666699 0.236512 Te\n0.333367 0.666732 0.087754 Mo\n0.666676 0.333350 0.287868 Mo\n0.333270 0.666539 0.477234 W\n0.666691 0.333381 0.650025 W\n0.666595 0.333186 0.431925 Se\n0.666614 0.333224 0.522537 Se\n0.333360 0.666719 0.691279 S\n0.333357 0.666712 0.608761 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":5.857752650973922,"density_atomic":0.03276402908363137,"volume":366.2553213272264,"volume_molar":18.38034249276323,"formula_full":"Te4 Mo2 W2 Se2 S2","formula_reduced":"Te2MoWSeS","formula_anonymous":"ABCDE2","energy_above_hull":3.4596358,"spacegroup":156}]}