{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3459","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3457","results":[{"id":"jvasp-56282","created_at":"2022-09-04T14:37:46.167383Z","updated_at":"2022-09-04T14:37:46.167417Z","structure_string":"Tl2 Hg2 Pd1 Cl8\n1.0\n6.330982 0.012627 1.868810\n2.763475 5.696026 1.868810\n-0.023695 -0.014873 9.771913\nTl Hg Pd Cl\n2 2 1 8\ndirect\n0.397409 0.397409 0.836112 Tl\n0.602592 0.602593 0.163887 Tl\n0.134236 0.134236 0.596767 Hg\n0.865765 0.865766 0.403232 Hg\n0.000000 0.000000 0.000000 Pd\n0.895306 0.380469 0.870562 Cl\n0.380468 0.895307 0.870561 Cl\n0.352878 0.352878 0.494579 Cl\n0.104695 0.619533 0.129438 Cl\n0.914694 0.914695 0.695936 Cl\n0.647123 0.647124 0.505420 Cl\n0.619532 0.104695 0.129438 Cl\n0.085307 0.085307 0.304063 Cl\n","nsites":13,"nelements":4,"elements":["Tl","Hg","Pd","Cl"],"chemical_system":"Cl-Hg-Pd-Tl","density":5.654473567041538,"density_atomic":0.03688999437416294,"volume":352.3990778677092,"volume_molar":16.324591158565735,"formula_full":"Tl2 Hg2 Pd1 Cl8","formula_reduced":"Tl2Hg2PdCl8","formula_anonymous":"AB2C2D8","energy_above_hull":0.0,"spacegroup":12},{"id":"jvasp-9285","created_at":"2022-09-04T14:38:01.953772Z","updated_at":"2022-09-04T14:38:01.953792Z","structure_string":"Zn1 Sb4 O8\n1.0\n3.235247 -0.296195 -0.466619\n0.695115 7.036696 0.324141\n-0.069515 3.604140 8.721214\nZn Sb O\n1 4 8\ndirect\n0.483883 0.910386 0.816251 Zn\n0.326057 0.741472 0.500114 Sb\n0.007719 0.318138 0.865000 Sb\n0.133468 0.615032 0.116015 Sb\n0.798229 0.197422 0.445737 Sb\n0.211105 0.311684 0.271051 O\n0.691115 0.659569 0.231900 O\n0.454839 0.250613 0.758463 O\n0.917624 0.608666 0.684359 O\n0.765556 -0.039620 0.379453 O\n0.045610 0.903547 0.940320 O\n0.372046 0.966182 0.593413 O\n0.570325 0.566280 -0.010874 O\n","nsites":13,"nelements":3,"elements":["Zn","Sb","O"],"chemical_system":"O-Sb-Zn","density":5.7893986258822245,"density_atomic":0.06660934943485494,"volume":195.16779716808702,"volume_molar":9.04098420281038,"formula_full":"Zn1 Sb4 O8","formula_reduced":"Zn(SbO2)4","formula_anonymous":"AB4C8","energy_above_hull":2.175180984615385,"spacegroup":8},{"id":"jvasp-13301","created_at":"2022-09-04T14:37:05.352543Z","updated_at":"2022-09-04T14:37:05.352573Z","structure_string":"Li1 Mn4 O8\n1.0\n5.730787 -0.000000 -0.000000\n2.865394 4.963007 -0.000000\n2.865394 1.654336 4.679169\nLi Mn O\n1 4 8\ndirect\n0.250000 0.250000 0.250000 Li\n0.121619 0.626127 0.626127 Mn\n0.626126 0.121621 0.626127 Mn\n0.626126 0.626127 0.121621 Mn\n0.626126 0.626127 0.626127 Mn\n0.387769 0.387770 0.387770 O\n0.387768 0.387771 0.836691 O\n0.387769 0.836692 0.387770 O\n0.836690 0.387770 0.387770 O\n0.416513 0.861163 0.861162 O\n0.861161 0.416516 0.861162 O\n0.861161 0.861163 0.416515 O\n0.861160 0.861163 0.861162 O\n","nsites":13,"nelements":3,"elements":["Li","Mn","O"],"chemical_system":"Li-Mn-O","density":4.425559380042877,"density_atomic":0.09768220768562162,"volume":133.08462521484904,"volume_molar":6.165033431043586,"formula_full":"Li1 Mn4 O8","formula_reduced":"LiMn4O8","formula_anonymous":"AB4C8","energy_above_hull":3.342612074270557,"spacegroup":216},{"id":"jvasp-12407","created_at":"2022-09-04T14:36:51.587424Z","updated_at":"2022-09-04T14:36:51.587450Z","structure_string":"Ti1 Fe6 Ge6\n1.0\n2.507483 -4.343087 0.000000\n2.507483 4.343087 -0.000000\n-0.000000 0.000000 7.964303\nTi Fe Ge\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Ti\n-0.000000 0.500000 0.248900 Fe\n0.500000 -0.000000 0.248900 Fe\n0.499999 0.499999 0.248900 Fe\n-0.000000 0.500000 0.751100 Fe\n0.500000 -0.000000 0.751100 Fe\n0.499999 0.499999 0.751100 Fe\n0.333332 0.666667 0.500000 Ge\n0.666667 0.333332 0.500000 Ge\n0.333332 0.666667 0.000000 Ge\n0.666667 0.333332 0.000000 Ge\n0.000000 0.000000 0.665376 Ge\n0.000000 0.000000 0.334624 Ge\n","nsites":13,"nelements":3,"elements":["Ti","Fe","Ge"],"chemical_system":"Fe-Ge-Ti","density":7.8379129461022226,"density_atomic":0.0749426517294394,"volume":173.4659729806874,"volume_molar":8.035665433538895,"formula_full":"Ti1 Fe6 Ge6","formula_reduced":"Ti(FeGe)6","formula_anonymous":"AB6C6","energy_above_hull":2.750119002564102,"spacegroup":191},{"id":"jvasp-101825","created_at":"2022-09-04T14:36:53.533514Z","updated_at":"2022-09-04T14:36:53.533525Z","structure_string":"H4 C6 S2 O1\n1.0\n4.521639 0.026144 -0.953430\n-1.544618 4.798238 -1.383614\n0.056134 -0.008288 6.794891\nH C S O\n4 6 2 1\ndirect\n0.985860 0.608107 0.852786 H\n0.332393 0.061570 0.216026 H\n0.293457 0.404020 0.566582 H\n0.295034 0.493063 0.971198 H\n0.182431 0.003339 0.311949 C\n0.159771 0.184668 0.499095 C\n0.952472 0.058759 0.595022 C\n0.991767 0.734611 0.267612 C\n0.042639 0.457556 0.929240 C\n0.873885 0.159668 0.785615 C\n0.779530 0.705612 0.448776 S\n0.605903 0.953607 0.854104 S\n0.939475 0.491420 0.118448 O\n","nsites":13,"nelements":4,"elements":["H","C","S","O"],"chemical_system":"C-H-O-S","density":1.7541730768347679,"density_atomic":0.08790532053616323,"volume":147.88638413134447,"volume_molar":6.850712474818359,"formula_full":"H4 C6 S2 O1","formula_reduced":"H4C6S2O","formula_anonymous":"AB2C4D6","energy_above_hull":4.979754115384615,"spacegroup":1},{"id":"jvasp-103903","created_at":"2022-09-04T14:37:03.705258Z","updated_at":"2022-09-04T14:37:03.705278Z","structure_string":"Zn1 H4 C4 O4\n1.0\n3.692658 0.062373 0.152379\n1.070635 4.100915 0.780411\n0.010388 -0.060135 7.329476\nZn H C O\n1 4 4 4\ndirect\n0.839987 0.933781 0.284771 Zn\n0.982800 0.611490 0.672650 H\n0.158625 0.176205 0.737854 H\n0.521587 0.691603 0.831681 H\n0.697445 0.256322 0.896880 H\n0.465174 0.393447 0.526646 C\n0.234794 0.407711 0.702638 C\n0.445438 0.460090 0.866892 C\n0.215073 0.474332 0.042887 C\n0.405732 0.646557 0.399802 O\n0.709966 0.124698 0.513821 O\n0.274514 0.221254 0.169745 O\n0.970257 0.743087 0.055691 O\n","nsites":13,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":2.7232573542322656,"density_atomic":0.11747660668538328,"volume":110.66032946300186,"volume_molar":5.12624677364748,"formula_full":"Zn1 H4 C4 O4","formula_reduced":"ZnH4(CO)4","formula_anonymous":"AB4C4D4","energy_above_hull":3.958581876923077,"spacegroup":2},{"id":"jvasp-103907","created_at":"2022-09-04T14:37:04.042723Z","updated_at":"2022-09-04T14:37:04.042748Z","structure_string":"Zn1 H4 C4 O4\n1.0\n3.606115 -0.051682 0.104947\n-0.386197 4.595353 -1.060417\n0.767337 0.386479 7.279930\nZn H C O\n1 4 4 4\ndirect\n0.480453 0.603748 0.280277 Zn\n0.950196 0.064489 0.767964 H\n0.399970 0.162735 0.829201 H\n0.809549 0.550736 0.776367 H\n0.282956 0.666228 0.717951 H\n0.349966 0.136274 0.538876 C\n0.197468 0.214609 0.743282 C\n0.096368 0.528720 0.800894 C\n0.150377 0.623434 0.003189 C\n0.522763 0.904184 0.498911 O\n0.292437 0.287488 0.421984 O\n0.414313 0.807423 0.049331 O\n-0.033531 0.481791 0.130066 O\n","nsites":13,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":2.4777041266596775,"density_atomic":0.10688386564640655,"volume":121.62733749737897,"volume_molar":5.634284205178786,"formula_full":"Zn1 H4 C4 O4","formula_reduced":"ZnH4(CO)4","formula_anonymous":"AB4C4D4","energy_above_hull":3.961311107692308,"spacegroup":1},{"id":"jvasp-12726","created_at":"2022-09-04T14:37:02.483001Z","updated_at":"2022-09-04T14:37:02.483021Z","structure_string":"Na2 Mn3 Cl8\n1.0\n6.507051 0.003270 4.242128\n2.300097 6.086975 4.242128\n0.004729 0.003270 7.767710\nNa Mn Cl\n2 3 8\ndirect\n0.158826 0.158826 0.158826 Na\n0.841174 0.841175 0.841174 Na\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.406265 0.406266 0.406265 Cl\n0.593735 0.593735 0.593735 Cl\n0.899117 0.420855 0.899117 Cl\n0.899117 0.899118 0.420855 Cl\n0.420855 0.899118 0.899117 Cl\n0.579145 0.100883 0.100883 Cl\n0.100883 0.579145 0.100883 Cl\n0.100883 0.100883 0.579145 Cl\n","nsites":13,"nelements":3,"elements":["Na","Mn","Cl"],"chemical_system":"Cl-Mn-Na","density":2.670555488780132,"density_atomic":0.04228651301187722,"volume":307.42662551411195,"volume_molar":14.241280093982997,"formula_full":"Na2 Mn3 Cl8","formula_reduced":"Na2Mn3Cl8","formula_anonymous":"A2B3C8","energy_above_hull":1.0607723848983204,"spacegroup":166},{"id":"jvasp-13093","created_at":"2022-09-04T14:37:02.287180Z","updated_at":"2022-09-04T14:37:02.287198Z","structure_string":"Mg5 H2 O6\n1.0\n1.514278 -2.622806 0.000000\n1.514278 2.622806 -0.000000\n-0.000000 -0.000000 14.712891\nMg H O\n5 2 6\ndirect\n0.666668 0.333334 0.668569 Mg\n0.333334 0.666668 0.331431 Mg\n0.333334 0.666668 0.834604 Mg\n0.666668 0.333334 0.165396 Mg\n0.000000 0.000000 0.000000 Mg\n0.333334 0.666668 0.529750 H\n0.666668 0.333334 0.470250 H\n0.333334 0.666668 0.082705 O\n0.666668 0.333334 0.917295 O\n0.000000 0.000000 0.248229 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