{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4571","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4569","results":[{"id":"jvasp-112579","created_at":"2022-09-04T14:38:41.685921Z","updated_at":"2022-09-04T14:38:41.685941Z","structure_string":"Na1 V1 H8 N2 F6\n1.0\n5.138185 -0.000000 2.966532\n1.712728 4.844327 2.966532\n-0.000000 -0.000000 5.933065\nNa V H N F\n1 1 8 2 6\ndirect\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 V\n0.961849 0.679384 0.679383 H\n0.679383 0.961850 0.679382 H\n0.679383 0.679384 0.961849 H\n0.038150 0.320616 0.320616 H\n0.320616 0.320616 0.038150 H\n0.679383 0.679384 0.679383 H\n0.320616 0.320616 0.320616 H\n0.320616 0.038150 0.320616 H\n0.250000 0.250000 0.250000 N\n0.749999 0.750000 0.749999 N\n0.234403 0.234403 0.765596 F\n0.765596 0.234403 0.234402 F\n0.234403 0.765598 0.765596 F\n0.234403 0.765598 0.234402 F\n0.765596 0.234403 0.765596 F\n0.765597 0.765598 0.234402 F\n","nsites":18,"nelements":5,"elements":["Na","V","H","N","F"],"chemical_system":"F-H-N-Na-V","density":2.518674954423988,"density_atomic":0.12188498572518065,"volume":147.68020763923604,"volume_molar":4.940838877052816,"formula_full":"Na1 V1 H8 N2 F6","formula_reduced":"NaVH8(NF3)2","formula_anonymous":"ABC2D6E8","energy_above_hull":2.260696188611112,"spacegroup":225},{"id":"jvasp-112055","created_at":"2022-09-04T14:38:43.039837Z","updated_at":"2022-09-04T14:38:43.039857Z","structure_string":"H14 C22 S2 N2 O2\n1.0\n3.816128 -0.006858 0.305261\n0.562246 9.661233 3.580738\n0.009086 0.033981 11.075707\nH C S N O\n14 22 2 2 2\ndirect\n0.178533 0.227534 0.666049 H\n0.103380 0.832839 0.432324 H\n0.624469 0.082110 0.723569 H\n0.625694 0.582376 0.723478 H\n0.542484 0.186216 0.492372 H\n0.543803 0.686479 0.492279 H\n0.930090 0.644470 0.891256 H\n0.102098 0.332549 0.432397 H\n0.507321 0.370559 0.057361 H\n0.507096 0.870467 0.057354 H\n0.458518 0.274413 0.306746 H\n0.458068 0.774265 0.306733 H\n0.179644 0.727760 0.665980 H\n0.929822 0.144497 0.891260 H\n0.914094 0.899584 0.711494 C\n0.825103 0.519883 0.441816 C\n0.825132 0.019916 0.441822 C\n0.962118 0.358144 0.852213 C\n0.040177 0.828684 0.628344 C\n0.039611 0.328568 0.628377 C\n0.998068 0.388613 0.495745 C\n0.998700 0.888763 0.495711 C\n0.914167 0.399601 0.711487 C\n0.962021 0.858133 0.852220 C\n0.683446 0.085984 0.528402 C\n0.792441 0.593645 0.304189 C\n0.730308 0.028311 0.658759 C\n0.730985 0.528452 0.658708 C\n0.792533 0.093705 0.304196 C\n0.842637 0.189029 0.062627 C\n0.842656 0.688990 0.062624 C\n0.611186 0.220364 0.250321 C\n0.610975 0.720275 0.250311 C\n0.636455 0.273788 0.115201 C\n0.636317 0.773717 0.115192 C\n0.684112 0.586113 0.528352 C\n0.999054 0.539949 0.181802 S\n0.998980 0.039972 0.181805 S\n0.929389 0.221569 0.930042 N\n0.929487 0.721547 0.930042 N\n0.003414 0.450188 0.898188 O\n0.003092 0.950197 0.898195 O\n","nsites":42,"nelements":5,"elements":["H","C","S","N","O"],"chemical_system":"C-H-N-O-S","density":1.6385025372191964,"density_atomic":0.1029659319089469,"volume":407.90190717781036,"volume_molar":5.848673098326734,"formula_full":"H14 C22 S2 N2 O2","formula_reduced":"H7C11SNO","formula_anonymous":"ABCD7E11","energy_above_hull":5.661766035714286,"spacegroup":1},{"id":"jvasp-111015","created_at":"2022-09-04T14:38:36.650590Z","updated_at":"2022-09-04T14:38:36.650614Z","structure_string":"Pr2 Fe1 As2 Ru1 O2\n1.0\n4.062465 0.000000 0.000000\n0.000000 4.062465 0.000000\n0.000000 -0.000000 8.472768\nPr Fe As Ru O\n2 1 2 1 2\ndirect\n0.500001 0.000000 0.857787 Pr\n-0.000000 0.500001 0.142213 Pr\n0.500001 0.500001 0.500000 Fe\n0.500001 0.000000 0.347873 As\n-0.000000 0.500001 0.652127 As\n0.000000 0.000000 0.500000 Ru\n0.500001 0.500001 -0.000000 O\n0.000000 0.000000 0.000000 O\n","nsites":8,"nelements":5,"elements":["Pr","Fe","As","Ru","O"],"chemical_system":"As-Fe-O-Pr-Ru","density":7.369481015083625,"density_atomic":0.05721177308921856,"volume":139.8313593169792,"volume_molar":10.526051605862326,"formula_full":"Pr2 Fe1 As2 Ru1 O2","formula_reduced":"Pr2FeAs2RuO2","formula_anonymous":"ABC2D2E2","energy_above_hull":2.790665775,"spacegroup":115},{"id":"jvasp-112101","created_at":"2022-09-04T14:38:42.906415Z","updated_at":"2022-09-04T14:38:42.906443Z","structure_string":"H2 C6 S2 N2 O4\n1.0\n4.867048 0.057081 0.555808\n1.946292 6.117018 1.367133\n0.001782 -0.095634 6.470801\nH C S N O\n2 6 2 2 4\ndirect\n0.211814 0.178614 0.605224 H\n0.711817 0.678614 0.105223 H\n0.669337 0.244415 0.721220 C\n0.410226 0.214016 0.860210 C\n0.169340 0.744415 0.221220 C\n0.910230 0.714015 0.360210 C\n0.393096 0.785255 0.337375 C\n0.893093 0.285255 0.837376 C\n0.699982 0.245104 0.468540 S\n0.199985 0.745105 0.968539 S\n0.174996 0.218343 0.753877 N\n0.674999 0.718344 0.253876 N\n0.322030 0.880616 0.489800 O\n0.822027 0.380617 0.989800 O\n0.409934 0.179855 0.053156 O\n0.909938 0.679853 0.553154 O\n","nsites":16,"nelements":5,"elements":["H","C","S","N","O"],"chemical_system":"C-H-N-O-S","density":1.9863858511108357,"density_atomic":0.08313605480920006,"volume":192.45560830040012,"volume_molar":7.243717270227712,"formula_full":"H2 C6 S2 N2 O4","formula_reduced":"HC3SNO2","formula_anonymous":"ABCD2E3","energy_above_hull":4.70525628125,"spacegroup":1},{"id":"jvasp-59832","created_at":"2022-09-04T14:38:36.252175Z","updated_at":"2022-09-04T14:38:36.252204Z","structure_string":"Y2 Sn6 Se4 Cl2 O16\n1.0\n7.126600 0.000000 0.000000\n0.000000 7.399157 0.000000\n0.000000 0.000000 10.458472\nY Sn Se Cl O\n2 6 4 2 16\ndirect\n0.500000 0.678603 0.000000 Y\n0.000000 0.321398 0.500000 Y\n0.750000 0.000000 0.750000 Sn\n0.750000 0.000000 0.250000 Sn\n0.250000 0.000000 0.750000 Sn\n0.000000 0.833484 0.500000 Sn\n0.500000 0.166517 0.000000 Sn\n0.250000 0.000000 0.250000 Sn\n0.500000 0.438699 0.318632 Se\n0.000000 0.561301 0.181368 Se\n0.000000 0.561301 0.818632 Se\n0.500000 0.438699 0.681368 Se\n0.500000 0.879822 0.500000 Cl\n0.000000 0.120178 0.000000 Cl\n0.190538 0.701055 0.151236 O\n0.809462 0.701055 0.151236 O\n0.690538 0.298945 0.651236 O\n0.000000 0.071723 0.375628 O\n0.500000 0.928278 0.124372 O\n0.309462 0.298945 0.651236 O\n0.190538 0.701055 0.848763 O\n0.500000 0.928278 0.875628 O\n0.309462 0.298945 0.348764 O\n0.690538 0.298945 0.348764 O\n0.809462 0.701055 0.848763 O\n0.000000 0.559927 0.349647 O\n0.500000 0.440074 0.849647 O\n0.000000 0.559927 0.650353 O\n0.000000 0.071723 0.624372 O\n0.500000 0.440074 0.150353 O\n","nsites":30,"nelements":5,"elements":["Y","Sn","Se","Cl","O"],"chemical_system":"Cl-O-Se-Sn-Y","density":4.615343403168118,"density_atomic":0.05439868364321848,"volume":551.483932897334,"volume_molar":11.070379569287134,"formula_full":"Y2 Sn6 Se4 Cl2 O16","formula_reduced":"YSn3Se2ClO8","formula_anonymous":"ABC2D3E8","energy_above_hull":2.088285290055555,"spacegroup":59},{"id":"jvasp-111841","created_at":"2022-09-04T14:38:42.321777Z","updated_at":"2022-09-04T14:38:42.321800Z","structure_string":"Li1 Mn2 P2 H4 O10\n1.0\n4.945232 0.065733 -1.222388\n-1.215496 5.022636 -1.330381\n0.025502 -0.096369 7.532633\nLi Mn P H O\n1 2 2 4 10\ndirect\n0.090104 0.394722 0.920474 Li\n0.989392 0.489936 0.494484 Mn\n0.512276 0.008002 0.002665 Mn\n0.427171 0.588936 0.256399 P\n0.568392 0.424180 0.746629 P\n0.884932 0.936215 0.293593 H\n0.075295 0.124821 0.207118 H\n0.116639 0.023417 0.686326 H\n0.925071 0.855662 0.786537 H\n0.669552 0.729823 0.844941 O\n0.243966 0.346706 0.688911 O\n0.319617 0.286212 0.133877 O\n0.747705 0.662384 0.333977 O\n0.328700 0.738831 0.110788 O\n0.690820 0.280438 0.891007 O\n0.296738 0.650502 0.422202 O\n0.103188 0.878622 0.747141 O\n0.678372 0.339379 0.571255 O\n0.907053 0.103712 0.254526 O\n","nsites":19,"nelements":5,"elements":["Li","Mn","P","H","O"],"chemical_system":"H-Li-Mn-O-P","density":3.0427152812637863,"density_atomic":0.1015633930057236,"volume":187.0752781854113,"volume_molar":5.929440304993181,"formula_full":"Li1 Mn2 P2 H4 O10","formula_reduced":"LiMn2P2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":3.191634762250453,"spacegroup":1},{"id":"jvasp-117223","created_at":"2022-09-04T14:38:48.771121Z","updated_at":"2022-09-04T14:38:48.771148Z","structure_string":"Ca2 Ti2 Si1 Ge1 O10\n1.0\n5.364429 -0.013955 1.342773\n-1.916062 5.010589 1.342773\n-0.012341 -0.017882 7.120537\nCa Ti Si Ge O\n2 2 1 1 10\ndirect\n0.827799 0.172200 0.500000 Ca\n0.171805 0.828195 -0.000000 Ca\n0.499202 0.504029 0.746351 Ti\n0.495971 0.500798 0.253649 Ti\n0.179831 0.820170 0.500000 Si\n0.817018 0.182981 -0.000000 Ge\n0.386150 0.812565 0.633838 O\n0.187435 0.613851 0.366162 O\n0.597249 0.181173 0.856292 O\n0.818827 0.402750 0.143708 O\n0.755239 0.868326 0.177024 O\n0.131674 0.244761 0.822976 O\n0.250708 0.120864 0.340359 O\n0.879136 0.749292 0.659640 O\n0.431998 0.568002 -0.000000 O\n0.569964 0.430036 0.500000 O\n","nsites":16,"nelements":5,"elements":["Ca","Ti","Si","Ge","O"],"chemical_system":"Ca-Ge-O-Si-Ti","density":3.7867243432595346,"density_atomic":0.08356826691973716,"volume":191.46023472482852,"volume_molar":7.206253021597233,"formula_full":"Ca2 Ti2 Si1 Ge1 O10","formula_reduced":"Ca2Ti2SiGeO10","formula_anonymous":"ABC2D2E10","energy_above_hull":2.525365441041666,"spacegroup":5},{"id":"jvasp-7109","created_at":"2022-09-04T14:38:32.360248Z","updated_at":"2022-09-04T14:38:32.360274Z","structure_string":"H5 Pb1 C1 I3 N2\n1.0\n6.486825 0.000000 -0.000000\n0.000001 6.309788 -0.000000\n-0.000000 0.000000 6.405316\nH Pb C I N\n5 1 1 3 2\ndirect\n0.500000 0.702262 0.500000 H\n0.809197 0.525307 0.500000 H\n0.697727 0.272228 0.500000 H\n0.302274 0.272228 0.500000 H\n0.190804 0.525307 0.500000 H\n-0.000000 0.945495 0.000000 Pb\n0.500001 0.528902 0.500000 C\n0.500000 0.958708 0.000000 I\n-0.000000 0.444545 0.000000 I\n-0.000000 0.926676 0.500000 I\n0.679569 0.433430 0.500000 N\n0.320430 0.433430 0.500000 N\n","nsites":12,"nelements":5,"elements":["H","Pb","C","I","N"],"chemical_system":"C-H-I-N-Pb","density":4.009125593096728,"density_atomic":0.045771351523680545,"volume":262.17272596356713,"volume_molar":13.1570088265459,"formula_full":"H5 Pb1 C1 I3 N2","formula_reduced":"H5PbCI3N2","formula_anonymous":"ABC2D3E5","energy_above_hull":2.8686113454166664,"spacegroup":25},{"id":"jvasp-112641","created_at":"2022-09-04T14:38:42.980896Z","updated_at":"2022-09-04T14:38:42.980924Z","structure_string":"Sr4 Mn2 Cu3 Se4 O4\n1.0\n9.428365 -0.026546 0.000000\n-7.664692 5.490653 0.000000\n-0.000000 -0.000000 5.741074\nSr Mn Cu Se O\n4 2 3 4 4\ndirect\n0.406302 0.096346 0.748847 Sr\n0.903653 0.593697 0.251152 Sr\n0.096346 0.406301 0.251152 Sr\n0.593698 0.903652 0.748847 Sr\n0.500000 -0.000000 0.250270 Mn\n-0.000000 0.500000 0.749729 Mn\n0.500000 0.499999 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.499999 0.500000 Cu\n0.165012 0.329059 0.753044 Se\n0.670940 0.834987 0.246956 Se\n0.329059 0.165012 0.246956 Se\n0.834988 0.670940 0.753044 Se\n0.751369 0.248630 0.500000 O\n0.248630 0.751369 0.500000 O\n0.749721 0.250278 -0.000000 O\n0.250278 0.749721 -0.000000 O\n","nsites":17,"nelements":5,"elements":["Sr","Mn","Cu","Se","O"],"chemical_system":"Cu-Mn-O-Se-Sr","density":5.782206934343088,"density_atomic":0.05742562001170393,"volume":296.03511458013384,"volume_molar":10.486853705319378,"formula_full":"Sr4 Mn2 Cu3 Se4 O4","formula_reduced":"Sr4Mn2Cu3(SeO)4","formula_anonymous":"A2B3C4D4E4","energy_above_hull":1.3838393258485464,"spacegroup":21},{"id":"jvasp-111796","created_at":"2022-09-04T14:38:41.877163Z","updated_at":"2022-09-04T14:38:41.877188Z","structure_string":"Na1 Sr2 La1 Ti4 O12\n1.0\n5.504401 0.000000 0.000000\n0.000000 5.504401 0.000000\n0.000000 0.000000 7.884874\nNa Sr La Ti O\n1 2 1 4 12\ndirect\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 La\n0.000000 0.500000 0.247722 Ti\n0.500000 0.000000 0.752277 Ti\n0.500000 0.000000 0.247722 Ti\n0.000000 0.500000 0.752277 Ti\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.718823 0.281176 0.751265 O\n0.208669 0.791331 0.245042 O\n0.281176 0.718823 0.751265 O\n0.718823 0.718823 0.248734 O\n0.791331 0.791331 0.754958 O\n0.281176 0.281176 0.248734 O\n0.500000 0.000000 0.000000 O\n0.208669 0.208669 0.754958 O\n0.791331 0.208669 0.245042 O\n0.000000 0.500000 0.500000 O\n","nsites":20,"nelements":5,"elements":["Na","Sr","La","Ti","O"],"chemical_system":"La-Na-O-Sr-Ti","density":5.008712227837437,"density_atomic":0.0837172796645738,"volume":238.8993058557694,"volume_molar":7.193426236648678,"formula_full":"Na1 Sr2 La1 Ti4 O12","formula_reduced":"NaSr2LaTi4O12","formula_anonymous":"ABC2D4E12","energy_above_hull":2.6329375976666665,"spacegroup":111},{"id":"jvasp-116763","created_at":"2022-09-04T14:38:45.445295Z","updated_at":"2022-09-04T14:38:45.445323Z","structure_string":"Sr4 La2 Mn2 Co2 O14\n1.0\n5.423343 -0.002845 0.000209\n0.004811 10.011457 2.706499\n-0.000168 0.002919 5.423418\nSr La Mn Co O\n4 2 2 2 14\ndirect\n0.000036 0.002204 0.498810 Sr\n0.500068 0.002204 0.998915 Sr\n0.000040 0.363329 0.318211 Sr\n0.500036 0.363328 0.818415 Sr\n0.499962 0.637028 0.182023 La\n0.999610 0.637028 0.681235 La\n0.500039 0.192377 0.403831 Mn\n0.000064 0.192377 0.903735 Mn\n0.000001 0.810820 0.094537 Co\n0.499939 0.810820 0.594682 Co\n0.250066 0.193754 0.153077 O\n0.750065 0.193957 0.652978 O\n0.249964 0.799131 0.850447 O\n0.749958 0.799720 0.350154 O\n0.249917 0.799564 0.350287 O\n0.749921 0.799281 0.850432 O\n0.500165 0.609685 0.694674 O\n0.499919 0.002385 0.499257 O\n0.000017 0.395612 0.802322 O\n0.500067 0.395612 0.302022 O\n0.750063 0.193699 0.153108 O\n0.999806 0.609684 0.195663 O\n0.000205 0.002385 0.998248 O\n0.250062 0.194017 0.652948 O\n","nsites":24,"nelements":5,"elements":["Sr","La","Mn","Co","O"],"chemical_system":"Co-La-Mn-O-Sr","density":6.091279965959938,"density_atomic":0.081514879074758,"volume":294.4247758496874,"volume_molar":7.387781014159443,"formula_full":"Sr4 La2 Mn2 Co2 O14","formula_reduced":"Sr2LaMnCoO7","formula_anonymous":"ABCD2E7","energy_above_hull":2.3393900217816093,"spacegroup":107},{"id":"jvasp-112090","created_at":"2022-09-04T14:38:42.577814Z","updated_at":"2022-09-04T14:38:42.577834Z","structure_string":"H6 C4 S2 N2 O2\n1.0\n5.422659 0.066672 0.726099\n2.409676 5.130241 1.555098\n0.039060 -0.116035 6.093504\nH C S N O\n6 4 2 2 2\ndirect\n0.937974 0.076248 0.889239 H\n0.437975 0.576252 0.389240 H\n0.659307 0.086445 0.750090 H\n0.159310 0.586443 0.250093 H\n0.163659 0.125835 0.533990 H\n0.663662 0.625834 0.033993 H\n0.808798 0.164801 0.740450 C\n0.308800 0.664801 0.240451 C\n0.939672 0.012952 0.384448 C\n0.439674 0.512951 0.884449 C\n0.668473 0.966544 0.360588 S\n0.168474 0.466545 0.860588 S\n0.976577 0.123316 0.539673 N\n0.476579 0.623315 0.039675 N\n0.161735 0.946221 0.236475 O\n0.661737 0.446219 0.736477 O\n","nsites":16,"nelements":5,"elements":["H","C","S","N","O"],"chemical_system":"C-H-N-O-S","density":1.749459144940349,"density_atomic":0.09457741727522738,"volume":169.17357717052897,"volume_molar":6.367419341210301,"formula_full":"H6 C4 S2 N2 O2","formula_reduced":"H3C2SNO","formula_anonymous":"ABCD2E3","energy_above_hull":4.23164584375,"spacegroup":1}]}