{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=111","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=109","results":[{"id":"jvasp-86732","created_at":"2022-09-04T14:37:40.615739Z","updated_at":"2022-09-04T14:37:40.615760Z","structure_string":"K2 Hg2 C4 I2 N4\n1.0\n4.376854 -0.000000 -0.000000\n-2.188426 8.052063 0.000000\n-0.000000 0.000000 9.705000\nK Hg C I N\n2 2 4 2 4\ndirect\n0.764227 0.528457 0.750000 K\n0.235771 0.471543 0.250000 K\n0.000000 0.000000 0.000000 Hg\n0.000000 0.000000 0.500000 Hg\n0.877191 0.754386 0.057055 C\n0.122807 0.245614 0.942945 C\n0.122807 0.245614 0.557055 C\n0.877191 0.754386 0.442945 C\n0.553768 0.107538 0.250000 I\n0.446230 0.892462 0.750000 I\n0.807133 0.614270 0.087485 N\n0.192865 0.385730 0.587485 N\n0.807133 0.614270 0.412514 N\n0.192865 0.385730 0.912514 N\n","nsites":14,"nelements":5,"elements":["K","Hg","C","I","N"],"chemical_system":"C-Hg-I-K-N","density":4.064827836205717,"density_atomic":0.0409320288730136,"volume":342.03044377382844,"volume_molar":14.712539118651861,"formula_full":"K2 Hg2 C4 I2 N4","formula_reduced":"KHgC2IN2","formula_anonymous":"ABCD2E2","energy_above_hull":3.160529339285715,"spacegroup":63},{"id":"jvasp-46403","created_at":"2022-09-04T14:38:10.760045Z","updated_at":"2022-09-04T14:38:10.760082Z","structure_string":"Li1 Sb1 Te2 W1 O12\n1.0\n5.084708 0.003518 0.001537\n-0.004477 5.332048 -0.048297\n-0.021744 -0.457611 7.357129\nLi Sb Te W O\n1 1 2 1 12\ndirect\n0.998716 0.578382 0.715288 Li\n0.499301 0.500071 0.491329 Sb\n0.503904 0.507095 -0.000941 Te\n0.000447 0.003702 0.496480 Te\n0.001711 0.012926 0.004065 W\n0.694572 0.193485 0.940042 O\n0.821232 0.314707 0.569521 O\n0.193329 0.310945 0.058447 O\n0.637448 0.505743 0.241295 O\n0.364408 0.496926 0.753068 O\n0.166121 0.679261 0.443874 O\n0.875381 0.005828 0.246634 O\n0.303087 0.811583 0.057746 O\n0.112019 -0.009880 0.752415 O\n0.316804 0.173300 0.431374 O\n0.812186 0.690332 0.933859 O\n0.699338 0.811201 0.572704 O\n","nsites":17,"nelements":5,"elements":["Li","Sb","Te","W","O"],"chemical_system":"Li-O-Sb-Te-W","density":6.328287481376859,"density_atomic":0.08527555914032568,"volume":199.35372070707334,"volume_molar":7.061977453692483,"formula_full":"Li1 Sb1 Te2 W1 O12","formula_reduced":"LiSbTe2WO12","formula_anonymous":"ABCD2E12","energy_above_hull":2.9308525666666663,"spacegroup":1},{"id":"jvasp-48610","created_at":"2022-09-04T14:37:05.593311Z","updated_at":"2022-09-04T14:37:05.593333Z","structure_string":"Li1 Nb1 Te2 W1 O12\n1.0\n5.107997 -0.000587 -0.000398\n-0.002268 5.381332 -0.032451\n-0.006099 -0.444567 7.415912\nLi Nb Te W O\n1 1 2 1 12\ndirect\n0.501778 0.928407 0.281941 Li\n0.506237 0.504114 0.506597 Nb\n0.004779 0.008238 0.494341 Te\n0.493465 0.504595 0.998841 Te\n0.993848 0.006215 0.989692 W\n0.693615 0.200535 0.941391 O\n0.314383 0.186324 0.429096 O\n0.824259 0.315634 0.554434 O\n0.192743 0.303414 0.056002 O\n0.376783 0.506601 0.755031 O\n0.801105 0.705915 0.938941 O\n0.874282 0.010945 0.244333 O\n0.197019 0.710172 0.435535 O\n0.694309 0.827053 0.546182 O\n0.305951 0.817910 0.059428 O\n0.611953 0.520018 0.241172 O\n0.112135 0.005034 0.749605 O\n","nsites":17,"nelements":5,"elements":["Li","Nb","Te","W","O"],"chemical_system":"Li-Nb-O-Te-W","density":5.9558996439287775,"density_atomic":0.08342592110647397,"volume":203.77359667750525,"volume_molar":7.218548719784735,"formula_full":"Li1 Nb1 Te2 W1 O12","formula_reduced":"LiNbTe2WO12","formula_anonymous":"ABCD2E12","energy_above_hull":3.201250407843137,"spacegroup":1},{"id":"jvasp-121977","created_at":"2022-09-04T14:38:54.164486Z","updated_at":"2022-09-04T14:38:54.164521Z","structure_string":"Fe1 Cu1 As2 Pb1 O10\n1.0\n5.152600 -0.024901 -0.405313\n-2.257641 4.897731 -1.836764\n0.218500 -0.069695 7.788304\nFe Cu As Pb O\n1 1 2 1 10\ndirect\n-0.000000 -0.000001 0.500000 Fe\n0.500000 0.500000 0.500000 Cu\n0.597045 0.236055 0.775985 As\n0.402954 0.763944 0.224015 As\n0.000000 0.000000 0.000000 Pb\n0.852648 0.645398 0.435633 O\n0.147352 0.354601 0.564367 O\n0.700531 -0.009955 0.629463 O\n0.299469 0.009954 0.370537 O\n0.773300 0.952333 0.276016 O\n0.226700 0.047666 0.723984 O\n0.307794 0.469517 0.271893 O\n0.692205 0.530482 0.728107 O\n0.711879 0.295735 -0.001019 O\n0.288121 0.704265 0.001020 O\n","nsites":15,"nelements":5,"elements":["Fe","Cu","As","Pb","O"],"chemical_system":"As-Cu-Fe-O-Pb","density":5.396628390587993,"density_atomic":0.07659761731668444,"volume":195.82854565807378,"volume_molar":7.862047111860048,"formula_full":"Fe1 Cu1 As2 Pb1 O10","formula_reduced":"FeCuAs2PbO10","formula_anonymous":"ABCD2E10","energy_above_hull":2.577499018,"spacegroup":2},{"id":"jvasp-108006","created_at":"2022-09-04T14:35:49.645325Z","updated_at":"2022-09-04T14:35:49.645355Z","structure_string":"Er2 Si2 Ru4 C2\n1.0\n5.893094 -0.009790 0.000000\n-4.685951 3.573585 0.000000\n-0.000000 -0.000000 7.118552\nEr Si Ru C\n2 2 4 2\ndirect\n0.546444 0.453557 0.250000 Er\n0.453556 0.546445 0.750000 Er\n0.268337 0.731664 0.250000 Si\n0.731663 0.268337 0.750000 Si\n0.836596 0.163404 0.055583 Ru\n0.163404 0.836598 0.944417 Ru\n0.163404 0.836598 0.555583 Ru\n0.836596 0.163404 0.444417 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n","nsites":10,"nelements":4,"elements":["Er","Si","Ru","C"],"chemical_system":"C-Er-Ru-Si","density":9.091506435859522,"density_atomic":0.06685100520850124,"volume":149.58638196704828,"volume_molar":9.008302479846904,"formula_full":"Er2 Si2 Ru4 C2","formula_reduced":"ErSiRu2C","formula_anonymous":"ABCD2","energy_above_hull":4.0383159200000005,"spacegroup":63},{"id":"jvasp-102686","created_at":"2022-09-04T14:36:54.444822Z","updated_at":"2022-09-04T14:36:54.444842Z","structure_string":"Sb1 Pb1 I1 O2\n1.0\n3.836883 0.008946 -6.382962\n-0.287660 3.826095 -6.382962\n-0.008280 -0.008946 7.447403\nSb Pb I O\n1 1 1 2\ndirect\n0.323081 0.323082 0.000001 Sb\n0.648086 0.648088 0.000001 Pb\n0.993841 0.993844 0.000002 I\n0.753895 0.253896 0.500000 O\n0.253895 0.753896 0.500000 O\n","nsites":5,"nelements":4,"elements":["Sb","Pb","I","O"],"chemical_system":"I-O-Pb-Sb","density":7.438271913921167,"density_atomic":0.04590868307453012,"volume":108.9118586103371,"volume_molar":13.117650859693361,"formula_full":"Sb1 Pb1 I1 O2","formula_reduced":"SbPbIO2","formula_anonymous":"ABCD2","energy_above_hull":1.114536039,"spacegroup":107},{"id":"jvasp-9786","created_at":"2022-09-04T14:37:17.163725Z","updated_at":"2022-09-04T14:37:17.163746Z","structure_string":"Rb2 S2 O4 F2\n1.0\n0.000000 4.812394 -0.079858\n5.835008 0.000000 0.000000\n0.000000 -2.112173 -6.675416\nRb S O F\n2 2 4 2\ndirect\n0.840307 0.750000 0.718126 Rb\n0.159693 0.250000 0.281875 Rb\n0.600988 0.750000 0.176525 S\n0.399012 0.250000 0.823476 S\n0.669326 0.541329 0.298926 O\n0.330674 0.041329 0.701075 O\n0.330674 0.458671 0.701075 O\n0.669326 0.958672 0.298926 O\n0.802418 0.250000 0.869947 F\n0.197582 0.750000 0.130054 F\n","nsites":10,"nelements":4,"elements":["Rb","S","O","F"],"chemical_system":"F-O-Rb-S","density":2.9703047937420983,"density_atomic":0.05306946310613746,"volume":188.4322812914138,"volume_molar":11.347657216648086,"formula_full":"Rb2 S2 O4 F2","formula_reduced":"RbSO2F","formula_anonymous":"ABCD2","energy_above_hull":0.8176074565,"spacegroup":11},{"id":"jvasp-103728","created_at":"2022-09-04T14:36:43.346323Z","updated_at":"2022-09-04T14:36:43.346344Z","structure_string":"Ba1 Bi1 Cl1 O2\n1.0\n3.852805 -0.060044 -6.120099\n-0.371508 3.835322 -6.120099\n0.055368 0.060044 7.231642\nBa Bi Cl O\n1 1 1 2\ndirect\n0.864763 0.864763 0.000001 Ba\n0.166736 0.166736 0.000000 Bi\n0.488068 0.488068 0.000000 Cl\n0.740217 0.240216 0.500001 O\n0.240216 0.740216 0.499999 O\n","nsites":5,"nelements":4,"elements":["Ba","Bi","Cl","O"],"chemical_system":"Ba-Bi-Cl-O","density":6.270477035882924,"density_atomic":0.04563245404027774,"volume":109.57113977667565,"volume_molar":13.197056539375513,"formula_full":"Ba1 Bi1 Cl1 O2","formula_reduced":"BaBiClO2","formula_anonymous":"ABCD2","energy_above_hull":0.7680902675000001,"spacegroup":107},{"id":"jvasp-99544","created_at":"2022-09-04T14:36:40.039362Z","updated_at":"2022-09-04T14:36:40.039391Z","structure_string":"Tm2 Si2 Ru4 C2\n1.0\n5.904839 -0.012133 0.000000\n-4.710156 3.561137 0.000000\n-0.000000 -0.000000 7.113833\nTm Si Ru C\n2 2 4 2\ndirect\n0.545725 0.454276 0.250000 Tm\n0.454276 0.545726 0.750000 Tm\n0.267885 0.732116 0.250000 Si\n0.732116 0.267886 0.750000 Si\n0.837001 0.163000 0.055070 Ru\n0.163000 0.837002 0.944929 Ru\n0.163000 0.837002 0.555070 Ru\n0.837001 0.163000 0.444929 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n","nsites":10,"nelements":4,"elements":["Tm","Si","Ru","C"],"chemical_system":"C-Ru-Si-Tm","density":9.153399995625538,"density_atomic":0.06703189466538913,"volume":149.18271443643593,"volume_molar":8.983993052951012,"formula_full":"Tm2 Si2 Ru4 C2","formula_reduced":"TmSiRu2C","formula_anonymous":"ABCD2","energy_above_hull":4.037432770000001,"spacegroup":63},{"id":"jvasp-111516","created_at":"2022-09-04T14:38:41.592279Z","updated_at":"2022-09-04T14:38:41.592303Z","structure_string":"H8 C4 Br4 Cl4\n1.0\n5.892180 0.075061 2.151171\n4.231771 4.100675 2.151171\n0.348319 0.143668 14.450777\nH C Br Cl\n8 4 4 4\ndirect\n0.209371 0.452654 0.528757 H\n0.547346 0.790630 0.971243 H\n0.790628 0.547347 0.471243 H\n0.452653 0.209372 0.028757 H\n0.021423 0.511007 0.659625 H\n0.488993 0.978578 0.840375 H\n0.978576 0.488994 0.340375 H\n0.511006 0.021424 0.159625 H\n0.340642 0.238196 0.107499 C\n0.761804 0.659359 0.392501 C\n0.659357 0.761805 0.892501 C\n0.238196 0.340643 0.607499 C\n0.606247 0.223904 0.632495 Br\n0.776096 0.393754 0.867505 Br\n0.393752 0.776097 0.367505 Br\n0.223903 0.606248 0.132495 Br\n0.316341 -0.009362 0.628712 Cl\n0.009361 0.683660 0.871288 Cl\n0.683659 0.009362 0.371288 Cl\n-0.009362 0.316342 0.128712 Cl\n","nsites":20,"nelements":4,"elements":["H","C","Br","Cl"],"chemical_system":"Br-C-Cl-H","density":2.519906950494824,"density_atomic":0.058644359520838796,"volume":341.03876593439753,"volume_molar":10.268917265368174,"formula_full":"H8 C4 Br4 Cl4","formula_reduced":"H2CBrCl","formula_anonymous":"ABCD2","energy_above_hull":2.3576376345000005,"spacegroup":15},{"id":"jvasp-102728","created_at":"2022-09-04T14:36:54.763893Z","updated_at":"2022-09-04T14:36:54.763915Z","structure_string":"La2 Ge4 Pd2 Rh2\n1.0\n4.423552 -0.000000 0.000000\n0.000000 4.423552 0.000000\n-0.000000 -0.000000 9.909768\nLa Ge Pd Rh\n2 4 2 2\ndirect\n-0.000000 0.500000 0.255276 La\n0.500000 0.000000 0.744725 La\n-0.000000 0.500000 0.867702 Ge\n0.500000 0.000000 0.132298 Ge\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.500000 Ge\n0.500000 0.500000 -0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n-0.000000 0.500000 0.621134 Rh\n0.500000 0.000000 0.378866 Rh\n","nsites":10,"nelements":4,"elements":["La","Ge","Pd","Rh"],"chemical_system":"Ge-La-Pd-Rh","density":8.452207356021752,"density_atomic":0.05156965654508197,"volume":193.91248012788378,"volume_molar":11.67768250450819,"formula_full":"La2 Ge4 Pd2 Rh2","formula_reduced":"LaGe2PdRh","formula_anonymous":"ABCD2","energy_above_hull":1.5356811200000002,"spacegroup":129},{"id":"jvasp-100535","created_at":"2022-09-04T14:36:37.160475Z","updated_at":"2022-09-04T14:36:37.160507Z","structure_string":"Yb1 Mn1 Cu1 P2\n1.0\n3.900633 0.000000 -0.000000\n-1.950316 3.378047 0.000000\n-0.000000 0.000000 6.510526\nYb Mn Cu P\n1 1 1 2\ndirect\n0.333332 0.666668 0.990394 Yb\n0.000000 -0.000000 0.376871 Mn\n0.666666 0.333333 0.634891 Cu\n0.666666 0.333333 0.272856 P\n0.000000 -0.000000 0.724989 P\n","nsites":5,"nelements":4,"elements":["Yb","Mn","Cu","P"],"chemical_system":"Cu-Mn-P-Yb","density":6.842057649056686,"density_atomic":0.058284509814271954,"volume":85.78608649078258,"volume_molar":10.332317761940544,"formula_full":"Yb1 Mn1 Cu1 P2","formula_reduced":"YbMnCuP2","formula_anonymous":"ABCD2","energy_above_hull":1.7750738782758615,"spacegroup":156}]}