{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=520","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=518","results":[{"id":"jvasp-33121","created_at":"2022-09-04T14:38:35.509500Z","updated_at":"2022-09-04T14:38:35.509516Z","structure_string":"Ru2 C6 Br4 O6\n1.0\n6.250716 -0.046306 1.532111\n1.924410 5.947290 1.532111\n0.055275 0.039898 9.329919\nRu C Br O\n2 6 4 6\ndirect\n0.064221 0.064222 0.785849 Ru\n0.935779 0.935778 0.214151 Ru\n0.091445 0.717289 0.358778 C\n0.717289 0.091445 0.358778 C\n0.908555 0.282711 0.641222 C\n0.755453 0.755452 0.208412 C\n0.282711 0.908555 0.641222 C\n0.244547 0.244547 0.791588 C\n0.760288 0.239713 -0.000000 Br\n0.176912 0.176912 0.226386 Br\n0.823088 0.823088 0.773614 Br\n0.239713 0.760287 -0.000000 Br\n0.584431 0.192684 0.443494 O\n0.645105 0.645104 0.213581 O\n0.354895 0.354895 0.786419 O\n0.807316 0.415568 0.556506 O\n0.415569 0.807316 0.556506 O\n0.192684 0.584431 0.443494 O\n","nsites":18,"nelements":4,"elements":["Ru","C","Br","O"],"chemical_system":"Br-C-O-Ru","density":3.302034875318025,"density_atomic":0.05188853657166129,"volume":346.8974303243431,"volume_molar":11.605917526086037,"formula_full":"Ru2 C6 Br4 O6","formula_reduced":"RuC3Br2O3","formula_anonymous":"AB2C3D3","energy_above_hull":3.8202832455555553,"spacegroup":12},{"id":"jvasp-31962","created_at":"2022-09-04T14:38:35.594857Z","updated_at":"2022-09-04T14:38:35.594885Z","structure_string":"Au2 C10 S8 Cl8\n1.0\n8.158447 -0.050845 0.728899\n0.641198 8.409963 2.243800\n0.010168 0.100085 8.727150\nAu C S Cl\n2 10 8 8\ndirect\n0.869085 0.151055 0.151055 Au\n0.130915 0.848944 0.848945 Au\n0.331365 0.658866 0.528780 C\n0.075072 0.520985 0.520986 C\n0.594761 0.051448 0.658568 C\n0.331365 0.528780 0.658867 C\n0.594761 0.658568 0.051448 C\n0.924929 0.479015 0.479015 C\n0.405240 0.341432 0.948552 C\n0.405240 0.948552 0.341432 C\n0.668636 0.471220 0.341133 C\n0.668636 0.341133 0.471220 C\n0.169262 0.687409 0.410166 S\n0.830739 0.589834 0.312591 S\n0.487767 0.478311 0.796984 S\n0.512234 0.521688 0.203016 S\n0.830739 0.312591 0.589834 S\n0.169262 0.410165 0.687409 S\n0.487767 0.796984 0.478312 S\n0.512234 0.203016 0.521688 S\n0.855437 0.382188 0.945712 Cl\n0.683031 0.038099 0.038099 Cl\n0.144564 0.054287 0.617812 Cl\n0.855437 0.945712 0.382188 Cl\n0.079393 0.250392 0.250392 Cl\n0.144564 0.617812 0.054288 Cl\n0.316970 0.961901 0.961901 Cl\n0.920608 0.749608 0.749608 Cl\n","nsites":28,"nelements":4,"elements":["Au","C","S","Cl"],"chemical_system":"Au-C-Cl-S","density":2.931079748718378,"density_atomic":0.046883507109522486,"volume":597.2249459621363,"volume_molar":12.84490246416921,"formula_full":"Au2 C10 S8 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O\n","nsites":20,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.3478940264427,"density_atomic":0.12195947000841582,"volume":163.9889054832716,"volume_molar":4.937821359492987,"formula_full":"Li6 Mn2 Co2 O10","formula_reduced":"Li3MnCoO5","formula_anonymous":"ABC3D5","energy_above_hull":2.395329564137931,"spacegroup":12},{"id":"jvasp-59225","created_at":"2022-09-04T14:38:35.848033Z","updated_at":"2022-09-04T14:38:35.848055Z","structure_string":"Li6 V2 P4 O16\n1.0\n0.000000 6.135118 0.012766\n5.424656 0.000000 0.000000\n0.000000 -0.064561 -8.178404\nLi V P O\n6 2 4 16\ndirect\n0.729308 0.750001 0.922234 Li\n0.500009 0.250000 0.749992 Li\n0.270666 0.750001 0.577768 Li\n0.729334 0.250000 0.422231 Li\n0.499991 0.750001 0.250007 Li\n0.270693 0.250000 0.077765 Li\n0.000001 0.250000 0.750001 V\n1.000000 0.750001 0.249998 V\n0.761655 0.250000 0.100667 P\n0.238361 0.250000 0.399332 P\n0.761639 0.750001 0.600668 P\n0.238346 0.750001 0.899332 P\n0.768751 0.479602 0.218732 O\n0.768751 0.020398 0.218732 O\n0.231254 0.479605 0.281267 O\n0.231254 0.020396 0.281267 O\n0.969136 0.750001 0.492866 O\n0.030845 0.750001 0.007128 O\n0.442185 0.250000 0.504200 O\n0.557838 0.250000 0.995789 O\n0.768746 0.979605 0.718732 O\n0.969156 0.250000 0.992872 O\n0.231249 0.979603 0.781267 O\n0.231249 0.520398 0.781267 O\n0.442163 0.750001 0.004210 O\n0.768746 0.520396 0.718732 O\n0.030864 0.250000 0.507133 O\n0.557816 0.750001 0.495799 O\n","nsites":28,"nelements":4,"elements":["Li","V","P","O"],"chemical_system":"Li-O-P-V","density":3.193289216411068,"density_atomic":0.10287301819902556,"volume":272.18021294786143,"volume_molar":5.853955551638558,"formula_full":"Li6 V2 P4 O16","formula_reduced":"Li3V(PO4)2","formula_anonymous":"AB2C3D8","energy_above_hull":2.6208645142857145,"spacegroup":12},{"id":"jvasp-10866","created_at":"2022-09-04T14:38:35.915209Z","updated_at":"2022-09-04T14:38:35.915229Z","structure_string":"Ho4 Hg2 O8\n1.0\n3.519787 0.000000 0.739980\n1.539905 6.708811 1.416385\n-0.007817 -0.019299 8.778281\nHo Hg O\n4 2 8\ndirect\n0.118975 0.224005 0.538044 Ho\n0.881026 0.775995 0.461956 Ho\n0.339643 0.520427 0.800288 Ho\n0.660359 0.479572 0.199712 Ho\n0.387774 0.063968 0.160485 Hg\n0.612228 0.936032 0.839515 Hg\n0.917487 0.512875 0.652153 O\n0.082515 0.487125 0.347848 O\n0.733073 0.146271 0.387585 O\n0.266929 0.853729 0.612415 O\n0.297735 0.351191 0.053340 O\n0.702267 0.648808 0.946661 O\n0.466122 0.785223 0.282536 O\n0.533880 0.214776 0.717464 O\n","nsites":14,"nelements":3,"elements":["Ho","Hg","O"],"chemical_system":"Hg-Ho-O","density":9.518860771331733,"density_atomic":0.0675025021887999,"volume":207.39971921104427,"volume_molar":8.921359304809892,"formula_full":"Ho4 Hg2 O8","formula_reduced":"Ho2HgO4","formula_anonymous":"AB2C4","energy_above_hull":1.3480885333333328,"spacegroup":12},{"id":"jvasp-119592","created_at":"2022-09-04T14:38:35.994679Z","updated_at":"2022-09-04T14:38:35.994697Z","structure_string":"Li12 Ti4 O14\n1.0\n5.813415 0.000000 0.000000\n-0.000000 4.758583 1.807846\n-0.000000 -0.015334 9.877040\nLi Ti O\n12 4 14\ndirect\n0.775717 0.227983 0.134364 Li\n0.224379 0.227963 0.134354 Li\n0.500059 0.814827 0.128718 Li\n0.000059 0.185173 0.371283 Li\n0.724379 0.772037 0.365647 Li\n0.275716 0.772017 0.365637 Li\n0.724285 0.227983 0.634364 Li\n0.275622 0.227964 0.634354 Li\n0.999942 0.814827 0.628717 Li\n0.499942 0.185173 0.871283 Li\n0.775622 0.772037 0.865647 Li\n0.224284 0.772017 0.865636 Li\n0.999919 0.261655 0.865035 Ti\n0.499918 0.738346 0.634965 Ti\n0.000082 0.738346 0.134965 Ti\n0.500083 0.261654 0.365035 Ti\n0.499953 0.950235 0.754983 O\n0.000000 0.500000 0.000000 O\n0.770385 -0.000009 0.000007 O\n0.500048 0.049765 0.245017 O\n0.250072 0.500020 0.249976 O\n0.750073 0.499980 0.250024 O\n0.000047 0.950235 0.254983 O\n0.270385 0.000010 0.499993 O\n0.500000 0.500000 0.500000 O\n0.729616 -0.000009 0.500007 O\n0.999954 0.049765 0.745017 O\n0.249928 0.500020 0.749976 O\n0.749928 0.499980 0.750024 O\n0.229616 0.000010 0.999993 O\n","nsites":30,"nelements":3,"elements":["Li","Ti","O"],"chemical_system":"Li-O-Ti","density":3.0292947716228626,"density_atomic":0.10973101354190704,"volume":273.3958161112108,"volume_molar":5.488093626055958,"formula_full":"Li12 Ti4 O14","formula_reduced":"Li6Ti2O7","formula_anonymous":"A2B6C7","energy_above_hull":2.1950787444444444,"spacegroup":12},{"id":"jvasp-54904","created_at":"2022-09-04T14:38:36.124550Z","updated_at":"2022-09-04T14:38:36.124576Z","structure_string":"Sr3 Al2 Ge4\n1.0\n4.209211 -0.000000 -0.000000\n-2.104605 5.928467 -2.226437\n-0.000000 -0.002400 8.949652\nSr Al Ge\n3 2 4\ndirect\n0.393753 0.787509 0.312396 Sr\n0.000000 0.000000 0.000000 Sr\n0.606246 0.212492 0.687604 Sr\n0.295418 0.590837 0.649612 Al\n0.704581 0.409163 0.350388 Al\n0.290026 0.580055 0.944934 Ge\n0.709973 0.419946 0.055065 Ge\n0.104720 0.209441 0.390711 Ge\n0.895278 0.790560 0.609289 Ge\n","nsites":9,"nelements":3,"elements":["Sr","Al","Ge"],"chemical_system":"Al-Ge-Sr","density":4.516544287672169,"density_atomic":0.04030296501761294,"volume":223.30863240624797,"volume_molar":14.942177969705808,"formula_full":"Sr3 Al2 Ge4","formula_reduced":"Sr3(AlGe2)2","formula_anonymous":"A2B3C4","energy_above_hull":0.57690537,"spacegroup":12},{"id":"jvasp-12786","created_at":"2022-09-04T14:38:36.185861Z","updated_at":"2022-09-04T14:38:36.185897Z","structure_string":"Y4 Cl6\n1.0\n3.759191 -0.000000 0.772243\n1.415000 7.170639 2.647723\n-0.004876 0.019940 9.559523\nY Cl\n4 6\ndirect\n0.137235 0.019504 0.706024 Y\n0.862763 0.980496 0.293975 Y\n0.410874 0.230769 0.947480 Y\n0.589125 0.769231 0.052519 Y\n0.950922 0.367316 0.730837 Cl\n0.049077 0.632684 0.269163 Cl\n0.770933 0.340767 0.117365 Cl\n0.229065 0.659233 0.882635 Cl\n0.342247 0.803734 0.511770 Cl\n0.657752 0.196266 0.488230 Cl\n","nsites":10,"nelements":2,"elements":["Y","Cl"],"chemical_system":"Cl-Y","density":3.6645635281266835,"density_atomic":0.038829684759842435,"volume":257.53492622587487,"volume_molar":15.50911576348434,"formula_full":"Y4 Cl6","formula_reduced":"Y2Cl3","formula_anonymous":"A2B3","energy_above_hull":0.9088386205,"spacegroup":12},{"id":"jvasp-119186","created_at":"2022-09-04T14:38:36.335871Z","updated_at":"2022-09-04T14:38:36.335886Z","structure_string":"Ga1 H6 N2 F3\n1.0\n4.064977 -0.065058 3.266072\n2.128081 3.464035 3.266072\n-0.076207 -0.041825 6.832909\nGa H N F\n1 6 2 3\ndirect\n0.500000 0.500000 0.500000 Ga\n0.826597 0.826597 0.032736 H\n0.173403 0.173402 0.967264 H\n0.367226 0.957437 0.767910 H\n0.042562 0.632774 0.232090 H\n0.632774 0.042562 0.232090 H\n0.957438 0.367226 0.767910 H\n0.779914 0.779914 0.218387 N\n0.220086 0.220085 0.781613 N\n0.481529 0.481529 0.236184 F\n0.518471 0.518471 0.763816 F\n0.000000 -0.000001 0.500000 F\n","nsites":12,"nelements":4,"elements":["Ga","H","N","F"],"chemical_system":"F-Ga-H-N","density":2.715844249559729,"density_atomic":0.12206945659537843,"volume":98.30468927027502,"volume_molar":4.933372301280482,"formula_full":"Ga1 H6 N2 F3","formula_reduced":"GaH6N2F3","formula_anonymous":"AB2C3D6","energy_above_hull":2.4261158060416665,"spacegroup":12},{"id":"jvasp-54506","created_at":"2022-09-04T14:38:36.414972Z","updated_at":"2022-09-04T14:38:36.414997Z","structure_string":"Rb2 Cr6 S10\n1.0\n3.486907 -0.000000 0.572238\n1.286639 9.253839 3.069704\n0.007636 -0.040586 10.863240\nRb Cr S\n2 6 10\ndirect\n0.253525 0.658227 0.834725 Rb\n0.746477 0.341773 0.165274 Rb\n0.980669 0.266612 0.772054 Cr\n0.835380 0.940613 0.388630 Cr\n0.500000 0.000000 0.000000 Cr\n0.019333 0.733388 0.227946 Cr\n0.164622 0.059387 0.611370 Cr\n0.500001 0.500000 0.500000 Cr\n0.593637 0.732406 0.080322 S\n0.255789 0.104521 0.383902 S\n0.926388 0.995341 0.151885 S\n0.918799 0.512497 0.649909 S\n0.406366 0.267594 0.919678 S\n0.073615 0.004659 0.848114 S\n0.425940 0.757469 0.390655 S\n0.744214 0.895479 0.616098 S\n0.574062 0.242531 0.609345 S\n0.081204 0.487502 0.350091 S\n","nsites":18,"nelements":3,"elements":["Rb","Cr","S"],"chemical_system":"Cr-Rb-S","density":3.802734761705742,"density_atomic":0.051297942123872675,"volume":350.89126882583633,"volume_molar":11.73953673513437,"formula_full":"Rb2 Cr6 S10","formula_reduced":"RbCr3S5","formula_anonymous":"AB3C5","energy_above_hull":2.908153577777778,"spacegroup":12},{"id":"jvasp-110730","created_at":"2022-09-04T14:38:37.914244Z","updated_at":"2022-09-04T14:38:37.914277Z","structure_string":"Pr2 S2 O2\n1.0\n4.013715 -0.004474 0.572052\n-0.092898 4.012642 0.572052\n0.028609 0.029246 7.044927\nPr S O\n2 2 2\ndirect\n0.714143 0.714143 0.678468 Pr\n0.285858 0.285858 0.321531 Pr\n0.853682 0.853681 0.120242 S\n0.146319 0.146320 0.879758 S\n0.743832 0.256170 0.500000 O\n0.256169 0.743831 0.500000 O\n","nsites":6,"nelements":3,"elements":["Pr","S","O"],"chemical_system":"O-Pr-S","density":5.537954315351905,"density_atomic":0.052944877966382475,"volume":113.32540994446563,"volume_molar":11.374359506171263,"formula_full":"Pr2 S2 O2","formula_reduced":"PrSO","formula_anonymous":"ABC","energy_above_hull":0.8794877833333334,"spacegroup":12}]}