{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=4431","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=4429","results":[{"id":"jvasp-54567","created_at":"2022-09-04T14:38:34.424934Z","updated_at":"2022-09-04T14:38:34.424950Z","structure_string":"Y4 Ge10 Ru6\n1.0\n5.462472 -0.000000 1.978594\n2.105500 7.743620 2.716822\n0.020833 -0.016233 8.472143\nY Ge Ru\n4 10 6\ndirect\n0.860429 0.370904 0.908237 Y\n0.639570 0.091762 0.629096 Y\n0.139570 0.629096 0.091762 Y\n0.360429 0.908238 0.370903 Y\n0.542234 0.707765 0.707765 Ge\n0.912917 0.762855 0.411308 Ge\n0.042234 0.707765 0.707765 Ge\n0.587081 0.588692 0.237145 Ge\n0.250000 -0.000000 -0.000000 Ge\n0.750000 -0.000000 -0.000000 Ge\n0.087081 0.237146 0.588691 Ge\n0.412917 0.411309 0.762854 Ge\n0.457765 0.292235 0.292235 Ge\n0.957764 0.292235 0.292234 Ge\n0.749999 0.500000 0.499999 Ru\n0.647405 0.760321 0.944865 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0.489704 Si\n0.662012 0.264891 0.057363 Si\n0.837987 0.942636 0.735109 Si\n0.337987 0.735108 0.942637 Si\n0.250000 0.775228 0.224771 Si\n0.750000 0.224771 0.775229 Si\n0.750000 0.997874 0.002125 Rh\n0.123929 0.462693 0.742180 Rh\n0.623929 0.742179 0.462693 Rh\n0.876070 0.537306 0.257820 Rh\n0.250000 0.002125 0.997875 Rh\n0.376070 0.257820 0.537307 Rh\n","nsites":20,"nelements":3,"elements":["Tb","Si","Rh"],"chemical_system":"Rh-Si-Tb","density":7.630023440150417,"density_atomic":0.05990794352889827,"volume":333.8455440446298,"volume_molar":10.052324291677701,"formula_full":"Tb4 Si10 Rh6","formula_reduced":"Tb2Si5Rh3","formula_anonymous":"A2B3C5","energy_above_hull":3.16807288,"spacegroup":15},{"id":"jvasp-11814","created_at":"2022-09-04T14:37:31.601066Z","updated_at":"2022-09-04T14:37:31.601094Z","structure_string":"Sr3 Fe2 O5\n1.0\n3.505572 0.000013 -0.578967\n-0.117338 3.810434 -0.710638\n-0.060309 -0.010035 10.538284\nSr Fe O\n3 2 5\ndirect\n0.314660 0.314656 0.629286 Sr\n0.685339 0.685343 0.370713 Sr\n0.500000 0.499999 -0.000000 Sr\n0.094819 0.094825 0.189674 Fe\n0.905181 0.905174 0.810325 Fe\n0.190339 0.190348 0.380725 O\n0.809661 0.809651 0.619273 O\n0.094721 0.594727 0.189478 O\n0.905278 0.405273 0.810520 O\n0.000000 0.000001 0.999999 O\n","nsites":10,"nelements":3,"elements":["Sr","Fe","O"],"chemical_system":"Fe-O-Sr","density":5.368025798573165,"density_atomic":0.07111917353648914,"volume":140.609058046341,"volume_molar":8.467675396860761,"formula_full":"Sr3 Fe2 O5","formula_reduced":"Sr3Fe2O5","formula_anonymous":"A2B3C5","energy_above_hull":1.828753743,"spacegroup":71},{"id":"jvasp-22950","created_at":"2022-09-04T14:38:07.995021Z","updated_at":"2022-09-04T14:38:07.995033Z","structure_string":"Lu12 O8 F20\n1.0\n5.223608 -0.000000 0.000000\n0.000000 5.504654 0.000000\n0.000000 0.000000 16.805387\nLu O F\n12 8 20\ndirect\n0.538656 0.173535 0.902840 Lu\n0.038656 0.326464 0.097160 Lu\n0.961345 0.673535 0.597160 Lu\n0.461344 0.826464 0.402840 Lu\n0.461344 0.826464 0.097160 Lu\n0.961345 0.673535 0.902840 Lu\n0.038656 0.326464 0.402840 Lu\n0.538656 0.173535 0.597160 Lu\n0.956700 0.239298 0.750000 Lu\n0.456700 0.260702 0.250000 Lu\n0.543301 0.739298 0.750000 Lu\n0.043300 0.760701 0.250000 Lu\n0.299264 0.537002 0.168476 O\n0.799264 0.962997 0.831524 O\n0.799264 0.962997 0.668476 O\n0.200737 0.037003 0.331524 O\n0.700737 0.462997 0.831524 O\n0.200737 0.037003 0.168476 O\n0.700737 0.462997 0.668476 O\n0.299264 0.537002 0.331524 O\n0.217213 0.615889 0.486278 F\n0.717213 0.884110 0.513722 F\n0.717213 0.884110 0.986278 F\n0.217213 0.615889 0.013722 F\n0.782788 0.384110 0.513722 F\n0.282787 0.115889 0.486278 F\n0.641669 0.888703 0.250000 F\n0.358331 0.111296 0.750000 F\n0.858331 0.388703 0.250000 F\n0.673653 0.163917 0.374618 F\n0.326348 0.836082 0.874618 F\n0.141669 0.611296 0.750000 F\n0.826348 0.663917 0.125382 F\n0.173652 0.336082 0.874618 F\n0.673653 0.163917 0.125382 F\n0.326348 0.836082 0.625383 F\n0.826348 0.663917 0.374618 F\n0.782788 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Rh\n","nsites":20,"nelements":3,"elements":["U","Si","Rh"],"chemical_system":"Rh-Si-U","density":9.236604172389585,"density_atomic":0.06012107767984708,"volume":332.6620342120732,"volume_molar":10.016687977665203,"formula_full":"U4 Si10 Rh6","formula_reduced":"U2Si5Rh3","formula_anonymous":"A2B3C5","energy_above_hull":4.283181399999999,"spacegroup":72},{"id":"jvasp-107745","created_at":"2022-09-04T14:36:00.256844Z","updated_at":"2022-09-04T14:36:00.256871Z","structure_string":"Nd2 Ga5 Cu3\n1.0\n4.224970 0.000000 0.000000\n0.000000 4.224970 0.000000\n-0.000000 -0.000000 10.253233\nNd Ga Cu\n2 5 3\ndirect\n0.500000 0.000000 0.743274 Nd\n-0.000000 0.500000 0.256726 Nd\n-0.000000 0.500000 0.862829 Ga\n0.500000 0.000000 0.380502 Ga\n0.500000 0.000000 0.137171 Ga\n-0.000000 0.500000 0.619497 Ga\n0.500000 0.500000 -0.000000 Ga\n0.000000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n","nsites":10,"nelements":3,"elements":["Nd","Ga","Cu"],"chemical_system":"Cu-Ga-Nd","density":7.509886622390134,"density_atomic":0.05463763773674893,"volume":183.0240181352874,"volume_molar":11.021963996714934,"formula_full":"Nd2 Ga5 Cu3","formula_reduced":"Nd2Ga5Cu3","formula_anonymous":"A2B3C5","energy_above_hull":0.00650704,"spacegroup":115},{"id":"jvasp-119107","created_at":"2022-09-04T14:38:34.708939Z","updated_at":"2022-09-04T14:38:34.708965Z","structure_string":"Er4 Si10 Rh6\n1.0\n7.849834 0.008391 -2.111841\n-1.534251 5.151106 -6.098527\n-0.027554 -0.008391 8.128900\nEr Si Rh\n4 10 6\ndirect\n0.637115 0.867877 0.769238 Er\n0.362885 0.132124 0.230763 Er\n0.098639 0.367877 0.730763 Er\n0.901361 0.632123 0.269237 Er\n0.000000 0.250000 0.250000 Si\n0.000001 0.750001 0.750000 Si\n0.237051 0.895389 0.341663 Si\n0.762949 0.104612 0.658338 Si\n0.553727 0.395389 0.158338 Si\n0.278461 0.528462 0.250000 Si\n0.721539 0.471539 0.750000 Si\n0.721539 0.971540 0.250000 Si\n0.278461 0.028461 0.750000 Si\n0.446273 0.604612 0.841663 Si\n0.500000 0.750001 0.250000 Rh\n0.250293 0.640491 0.609803 Rh\n0.749707 0.359510 0.390198 Rh\n0.030689 0.140491 0.890198 Rh\n0.969312 0.859510 0.109802 Rh\n0.500000 0.250000 0.750000 Rh\n","nsites":20,"nelements":3,"elements":["Er","Si","Rh"],"chemical_system":"Er-Rh-Si","density":7.933019062157373,"density_atomic":0.06096219730009173,"volume":328.0721641568833,"volume_molar":9.878483759952891,"formula_full":"Er4 Si10 Rh6","formula_reduced":"Er2Si5Rh3","formula_anonymous":"A2B3C5","energy_above_hull":3.1541612,"spacegroup":72},{"id":"jvasp-112905","created_at":"2022-09-04T14:38:43.055021Z","updated_at":"2022-09-04T14:38:43.055048Z","structure_string":"Li6 Mn4 O10\n1.0\n4.712348 -0.000047 1.742933\n-0.058998 7.100673 2.455278\n-0.118253 0.000020 4.910606\nLi Mn O\n6 4 10\ndirect\n0.500000 0.800001 0.099999 Li\n0.000000 0.800001 0.600000 Li\n0.500010 0.196444 0.901784 Li\n0.499991 0.403554 0.298217 Li\n0.499996 0.610696 0.694642 Li\n0.500005 0.989302 0.505360 Li\n0.000006 0.993053 0.003466 Mn\n0.000004 0.197214 0.401382 Mn\n-0.000008 0.606948 0.196536 Mn\n-0.000005 0.402785 0.798620 Mn\n0.773768 0.587527 0.956580 O\n0.234327 0.799996 0.873142 O\n0.765674 0.800002 0.326859 O\n0.224615 0.198626 0.658499 O\n0.224618 0.401375 0.057126 O\n0.775381 0.198624 0.142874 O\n0.775387 0.401374 0.541501 O\n0.226224 0.587527 0.455905 O\n0.226234 0.012472 0.243421 O\n0.773776 0.012472 0.744096 O\n","nsites":20,"nelements":3,"elements":["Li","Mn","O"],"chemical_system":"Li-Mn-O","density":4.220978936853461,"density_atomic":0.12064452316847016,"volume":165.7762779009176,"volume_molar":4.991640400941016,"formula_full":"Li6 Mn4 O10","formula_reduced":"Li3Mn2O5","formula_anonymous":"A2B3C5","energy_above_hull":2.494556198275862,"spacegroup":12},{"id":"jvasp-102733","created_at":"2022-09-04T14:38:42.540130Z","updated_at":"2022-09-04T14:38:42.540156Z","structure_string":"La2 Ga5 Cu3\n1.0\n4.312658 0.000000 0.000000\n0.000000 4.312658 0.000000\n0.000000 0.000000 10.209349\nLa Ga Cu\n2 5 3\ndirect\n0.500000 0.000000 0.744644 La\n-0.000000 0.500000 0.255356 La\n-0.000000 0.500000 0.865346 Ga\n0.500000 0.000000 0.382891 Ga\n0.500000 0.000000 0.134654 Ga\n-0.000000 0.500000 0.617109 Ga\n0.500000 0.500000 -0.000000 Ga\n0.000000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n","nsites":10,"nelements":3,"elements":["La","Ga","Cu"],"chemical_system":"Cu-Ga-La","density":7.145243813405527,"density_atomic":0.052663765853768287,"volume":189.88387628349716,"volume_molar":11.435074310336455,"formula_full":"La2 Ga5 Cu3","formula_reduced":"La2Ga5Cu3","formula_anonymous":"A2B3C5","energy_above_hull":0.0515815599999997,"spacegroup":115},{"id":"jvasp-116501","created_at":"2022-09-04T14:38:42.399150Z","updated_at":"2022-09-04T14:38:42.399173Z","structure_string":"Li6 Mn4 O10\n1.0\n2.834096 0.073740 -0.028384\n1.131139 11.751220 1.137796\n0.053786 -0.046575 5.030816\nLi Mn O\n6 4 10\ndirect\n0.899881 0.200007 0.299995 Li\n0.399946 0.200002 0.800003 Li\n0.303749 0.392234 0.092794 Li\n0.496235 0.007773 0.507216 Li\n0.701828 0.596383 0.900323 Li\n0.098233 0.803623 0.699665 Li\n0.996734 0.006220 0.992473 Mn\n0.600916 0.798159 0.201280 Mn\n0.803280 0.393778 0.607538 Mn\n0.199147 0.601839 0.398712 Mn\n0.053952 0.891469 0.328910 O\n0.455152 0.088867 0.141360 O\n0.344848 0.311129 0.458651 O\n0.844753 0.310689 0.922644 O\n0.955224 0.089311 0.677375 O\n0.250409 0.498976 0.721112 O\n0.549603 0.901021 0.878886 O\n0.651066 0.697411 0.534272 O\n0.148970 0.702584 0.065724 O\n0.746103 0.508528 0.271087 O\n","nsites":20,"nelements":3,"elements":["Li","Mn","O"],"chemical_system":"Li-Mn-O","density":4.182504419310138,"density_atomic":0.1195448399213864,"volume":167.3012403810332,"volume_molar":5.03755809448589,"formula_full":"Li6 Mn4 O10","formula_reduced":"Li3Mn2O5","formula_anonymous":"A2B3C5","energy_above_hull":2.4975401982758623,"spacegroup":12}]}