{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=509","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=507","results":[{"id":"jvasp-49210","created_at":"2022-09-04T14:38:30.177100Z","updated_at":"2022-09-04T14:38:30.177116Z","structure_string":"Na12 Mn2 Te8\n1.0\n5.009161 -8.676121 -0.000000\n5.009161 8.676121 0.000000\n0.000000 0.000000 7.672733\nNa Mn Te\n12 2 8\ndirect\n0.298519 0.149260 0.456600 Na\n0.946908 0.473454 0.129114 Na\n0.473454 0.946908 0.629114 Na\n0.526546 0.053092 0.129114 Na\n0.526546 0.473454 0.129114 Na\n0.053092 0.526546 0.629114 Na\n0.473454 0.526546 0.629114 Na\n0.850740 0.149260 0.456600 Na\n0.850740 0.701481 0.456600 Na\n0.149260 0.298519 0.956599 Na\n0.149260 0.850740 0.956599 Na\n0.701481 0.850740 0.956599 Na\n0.666667 0.333333 0.748130 Mn\n0.333333 0.666667 0.248130 Mn\n0.815276 0.184724 0.858523 Te\n0.666667 0.333333 0.392457 Te\n0.333333 0.666667 0.892457 Te\n0.369449 0.184724 0.858523 Te\n0.184724 0.815276 0.358523 Te\n0.184724 0.369449 0.358523 Te\n0.815276 0.630551 0.858523 Te\n0.630551 0.815276 0.358523 Te\n","nsites":22,"nelements":3,"elements":["Na","Mn","Te"],"chemical_system":"Mn-Na-Te","density":3.502149053156555,"density_atomic":0.032987697902922095,"volume":666.9152865635771,"volume_molar":18.255716957643624,"formula_full":"Na12 Mn2 Te8","formula_reduced":"Na6MnTe4","formula_anonymous":"AB4C6","energy_above_hull":0.3251002098223619,"spacegroup":186},{"id":"jvasp-45259","created_at":"2022-09-04T14:38:05.908439Z","updated_at":"2022-09-04T14:38:05.908459Z","structure_string":"Na2 Sr6 Sb2 O12\n1.0\n6.879738 -0.004854 -0.141887\n-0.144743 6.878217 -0.141887\n-0.004756 -0.004854 6.881200\nNa Sr Sb O\n2 6 2 12\ndirect\n0.750000 0.750001 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.898711 0.250001 0.601289 Sr\n0.398710 0.101290 0.750000 Sr\n0.750000 0.398711 0.101289 Sr\n0.101290 0.750001 0.398710 Sr\n0.601290 0.898712 0.249999 Sr\n0.250000 0.601290 0.898710 Sr\n0.500000 0.500001 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.074910 0.280790 0.945473 O\n0.780790 0.574911 0.445473 O\n0.554527 0.219211 0.425090 O\n0.425090 0.554527 0.219210 O\n0.219211 0.425091 0.554526 O\n0.719210 0.054528 0.925090 O\n0.925091 0.719212 0.054526 O\n0.054527 0.925091 0.719210 O\n0.445474 0.780790 0.574910 O\n0.574910 0.445474 0.780789 O\n0.945474 0.074911 0.280789 O\n0.280790 0.945474 0.074910 O\n","nsites":22,"nelements":4,"elements":["Na","Sr","Sb","O"],"chemical_system":"Na-O-Sb-Sr","density":5.136618097716867,"density_atomic":0.06756625121710179,"volume":325.6063434585157,"volume_molar":8.912941966618575,"formula_full":"Na2 Sr6 Sb2 O12","formula_reduced":"NaSr3SbO6","formula_anonymous":"ABC3D6","energy_above_hull":1.269331366363636,"spacegroup":167},{"id":"jvasp-34409","created_at":"2022-09-04T14:38:05.919336Z","updated_at":"2022-09-04T14:38:05.919352Z","structure_string":"Yb8 Cl12 O2\n1.0\n4.440533 -7.691228 -0.000000\n4.440533 7.691228 0.000000\n0.000000 0.000000 6.698765\nYb Cl O\n8 12 2\ndirect\n0.333333 0.666667 0.569925 Yb\n0.396297 0.198148 0.498403 Yb\n0.603702 0.801851 0.998403 Yb\n0.198148 0.801851 0.998403 Yb\n0.198148 0.396297 0.998403 Yb\n0.801851 0.603702 0.498403 Yb\n0.801851 0.198148 0.498403 Yb\n0.666667 0.333333 0.069925 Yb\n0.725188 0.862594 0.611211 Cl\n0.137406 0.274811 0.611211 Cl\n0.137405 0.862594 0.611211 Cl\n0.274811 0.137406 0.111210 Cl\n0.069580 0.534790 0.288562 Cl\n0.930419 0.465209 0.788562 Cl\n0.534790 0.465209 0.788562 Cl\n0.862594 0.137405 0.111210 Cl\n0.465209 0.930419 0.288562 Cl\n0.862594 0.725188 0.111210 Cl\n0.465209 0.534790 0.288562 Cl\n0.534790 0.069580 0.788562 Cl\n0.333333 0.666667 0.894054 O\n0.666667 0.333333 0.394054 O\n","nsites":22,"nelements":3,"elements":["Yb","Cl","O"],"chemical_system":"Cl-O-Yb","density":6.683829794398065,"density_atomic":0.0480802984597326,"volume":457.56787509181265,"volume_molar":12.525173413895425,"formula_full":"Yb8 Cl12 O2","formula_reduced":"Yb4Cl6O","formula_anonymous":"AB4C6","energy_above_hull":0.0,"spacegroup":186},{"id":"jvasp-48213","created_at":"2022-09-04T14:38:30.165409Z","updated_at":"2022-09-04T14:38:30.165424Z","structure_string":"Li2 P4 W2 O14\n1.0\n0.000000 4.901239 0.011697\n8.474949 0.000000 0.000000\n0.000000 -2.346289 -6.683319\nLi P W O\n2 4 2 14\ndirect\n0.816925 0.390689 0.333486 Li\n0.183075 0.890689 0.666513 Li\n0.197685 0.960597 0.076496 P\n0.408162 0.568854 0.534042 P\n0.591838 0.068854 0.465957 P\n0.802315 0.460597 0.923503 P\n0.786510 0.745573 0.272996 W\n0.213490 0.245573 0.727003 W\n0.129205 0.043112 0.874093 O\n0.071428 0.429592 0.868605 O\n0.791790 0.213122 0.505697 O\n0.759318 0.913222 0.486807 O\n0.392992 0.064339 0.592705 O\n0.607007 0.564340 0.407295 O\n0.870795 0.543112 0.125906 O\n0.208210 0.713122 0.494303 O\n0.928572 0.929592 0.131395 O\n0.605135 0.589058 0.764799 O\n0.394865 0.089058 0.235200 O\n0.374690 0.810997 0.081962 O\n0.240682 0.413221 0.513193 O\n0.625310 0.310997 0.918038 O\n","nsites":22,"nelements":4,"elements":["Li","P","W","O"],"chemical_system":"Li-O-P-W","density":4.366894253973889,"density_atomic":0.07931430720702191,"volume":277.37744644956416,"volume_molar":7.592754664402899,"formula_full":"Li2 P4 W2 O14","formula_reduced":"LiP2WO7","formula_anonymous":"ABC2D7","energy_above_hull":3.267279590909091,"spacegroup":4},{"id":"jvasp-21925","created_at":"2022-09-04T14:38:30.188316Z","updated_at":"2022-09-04T14:38:30.188352Z","structure_string":"Sc2 Si14 Rh6\n1.0\n6.665498 -0.012492 4.307368\n2.338629 6.241782 4.307368\n-0.018057 -0.012492 7.936117\nSc Si Rh\n2 14 6\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Sc\n0.750000 0.750000 0.750001 Si\n0.931919 0.148733 0.327676 Si\n0.148732 0.327676 0.931920 Si\n0.327676 0.931919 0.148733 Si\n0.351268 0.568081 0.172325 Si\n0.568081 0.172325 0.351268 Si\n0.172324 0.351268 0.568081 Si\n0.648732 0.431920 0.827676 Si\n0.827676 0.648733 0.431920 Si\n0.672324 0.068081 0.851268 Si\n0.851268 0.672324 0.068081 Si\n0.068081 0.851268 0.672325 Si\n0.250000 0.250000 0.250000 Si\n0.431919 0.827676 0.648733 Si\n0.750000 0.428361 0.071639 Rh\n0.428360 0.071640 0.750000 Rh\n0.928360 0.250000 0.571640 Rh\n0.250000 0.571640 0.928361 Rh\n0.571639 0.928361 0.250000 Rh\n0.071639 0.750000 0.428361 Rh\n","nsites":22,"nelements":3,"elements":["Sc","Si","Rh"],"chemical_system":"Rh-Sc-Si","density":5.5189589087763125,"density_atomic":0.06643916905728037,"volume":331.12996914565196,"volume_molar":9.064142200225332,"formula_full":"Sc2 Si14 Rh6","formula_reduced":"ScSi7Rh3","formula_anonymous":"AB3C7","energy_above_hull":3.604291313636363,"spacegroup":167},{"id":"jvasp-55419","created_at":"2022-09-04T14:38:30.154526Z","updated_at":"2022-09-04T14:38:30.154550Z","structure_string":"Er4 Mn4 O14\n1.0\n6.058108 -0.000000 3.497651\n2.019370 5.711639 3.497651\n0.000000 0.000000 6.995301\nEr Mn O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Er\n0.000000 0.500000 0.500001 Er\n0.500000 0.000000 0.500000 Er\n0.500000 0.500000 -0.000000 Er\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.000000 0.500000 0.000001 Mn\n0.670337 0.670338 0.079663 O\n0.079663 0.079663 0.670337 O\n0.670337 0.079663 0.079663 O\n0.329662 0.920338 0.920336 O\n0.375000 0.375001 0.375000 O\n0.670337 0.079663 0.670336 O\n0.079663 0.670338 0.079663 O\n0.329662 0.920338 0.329663 O\n0.329662 0.329663 0.920336 O\n0.920336 0.920338 0.329663 O\n0.920336 0.329663 0.920336 O\n0.079663 0.670338 0.670337 O\n0.624999 0.625000 0.625000 O\n0.920336 0.329663 0.329663 O\n","nsites":22,"nelements":3,"elements":["Er","Mn","O"],"chemical_system":"Er-Mn-O","density":7.634035143261474,"density_atomic":0.09089050420548474,"volume":242.04948792299055,"volume_molar":6.625709487082586,"formula_full":"Er4 Mn4 O14","formula_reduced":"Er2Mn2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.8289380893416927,"spacegroup":227},{"id":"jvasp-59250","created_at":"2022-09-04T14:38:05.969926Z","updated_at":"2022-09-04T14:38:05.969938Z","structure_string":"Ho4 Ti4 O14\n1.0\n7.154494 -0.000000 -0.000000\n3.577248 6.195973 -0.000000\n3.577248 2.065324 5.841620\nHo Ti O\n4 4 14\ndirect\n0.000001 0.499999 0.500000 Ho\n0.500000 0.500000 0.000000 Ho\n0.500000 -0.000000 0.500000 Ho\n0.500000 0.499999 0.500000 Ho\n0.000000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Ti\n0.000000 -0.000000 0.500000 Ti\n0.500000 0.000000 0.000000 Ti\n0.668836 0.081164 0.081164 O\n0.918836 0.331164 0.331164 O\n0.918836 0.918835 0.331164 O\n0.625000 0.624999 0.625000 O\n0.331165 0.331163 0.918836 O\n0.331165 0.918835 0.331164 O\n0.375000 0.375000 0.375000 O\n0.081165 0.668835 0.668836 O\n0.081164 0.081164 0.668836 O\n0.081164 0.668836 0.081164 O\n0.918836 0.331163 0.918836 O\n0.668836 0.081164 0.668836 O\n0.668836 0.668836 0.081164 O\n0.331165 0.918835 0.918836 O\n","nsites":22,"nelements":3,"elements":["Ho","Ti","O"],"chemical_system":"Ho-O-Ti","density":6.894597019270685,"density_atomic":0.08495734619585184,"volume":258.9534747152234,"volume_molar":7.088428522846256,"formula_full":"Ho4 Ti4 O14","formula_reduced":"Ho2Ti2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.679653845454545,"spacegroup":227},{"id":"jvasp-47749","created_at":"2022-09-04T14:38:14.708386Z","updated_at":"2022-09-04T14:38:14.708409Z","structure_string":"Li4 Cr2 Si4 O12\n1.0\n2.990309 4.948446 0.075178\n-2.990309 4.948446 -0.075178\n-0.339505 0.000000 8.912985\nLi Cr Si O\n4 2 4 12\ndirect\n0.605408 0.690503 0.884928 Li\n0.309498 0.394593 0.384928 Li\n0.690502 0.605409 0.615073 Li\n0.394592 0.309498 0.115073 Li\n0.238859 0.238860 0.750000 Cr\n0.761141 0.761141 0.250000 Cr\n0.127246 0.793216 0.639443 Si\n0.206785 0.872754 0.139443 Si\n0.793215 0.127247 0.860557 Si\n0.872754 0.206785 0.360557 Si\n0.762705 0.508443 0.409043 O\n0.491557 0.237296 0.909043 O\n0.000000 0.000000 0.000000 O\n0.131232 0.131232 0.250000 O\n-0.000000 0.000000 0.500000 O\n0.351306 0.846443 0.723559 O\n0.508443 0.762705 0.090957 O\n0.237295 0.491558 0.590958 O\n0.153558 0.648694 0.223559 O\n0.846442 0.351307 0.776442 O\n0.868768 0.868769 0.750000 O\n0.648694 0.153558 0.276442 O\n","nsites":22,"nelements":4,"elements":["Li","Cr","Si","O"],"chemical_system":"Cr-Li-O-Si","density":2.742663029154481,"density_atomic":0.08332377007081777,"volume":264.03029989283925,"volume_molar":7.2273983220895035,"formula_full":"Li4 Cr2 Si4 O12","formula_reduced":"Li2Cr(SiO3)2","formula_anonymous":"AB2C2D6","energy_above_hull":2.7396295999999998,"spacegroup":15},{"id":"jvasp-27487","created_at":"2022-09-04T14:38:16.112948Z","updated_at":"2022-09-04T14:38:16.112974Z","structure_string":"Sr6 Li2 Ru2 O12\n1.0\n6.703413 -0.006053 -0.272623\n-0.283689 6.697410 -0.272623\n-0.005807 -0.006053 6.708952\nSr Li Ru O\n6 2 2 12\ndirect\n0.890398 0.250001 0.609601 Sr\n0.390399 0.109601 0.750000 Sr\n0.750000 0.390400 0.109601 Sr\n0.109600 0.750000 0.390399 Sr\n0.249999 0.609601 0.890399 Sr\n0.609600 0.890400 0.250000 Sr\n0.250000 0.250000 0.250000 Li\n0.749999 0.750001 0.750000 Li\n0.000000 0.000000 0.000000 Ru\n0.499999 0.500000 0.500000 Ru\n0.219763 0.416188 0.546869 O\n0.083811 0.280237 0.953131 O\n0.953131 0.083812 0.280237 O\n0.546868 0.219764 0.416188 O\n0.583811 0.453132 0.780237 O\n0.780236 0.583812 0.453132 O\n0.719763 0.046869 0.916188 O\n0.916188 0.719764 0.046869 O\n0.046868 0.916188 0.719763 O\n0.453131 0.780237 0.583812 O\n0.416188 0.546869 0.219764 O\n0.280236 0.953132 0.083812 O\n","nsites":22,"nelements":4,"elements":["Sr","Li","Ru","O"],"chemical_system":"Li-O-Ru-Sr","density":5.148297493533,"density_atomic":0.07304889870279584,"volume":301.16812697626585,"volume_molar":8.243985695802847,"formula_full":"Sr6 Li2 Ru2 O12","formula_reduced":"Sr3LiRuO6","formula_anonymous":"ABC3D6","energy_above_hull":1.7522791299999998,"spacegroup":167},{"id":"jvasp-54747","created_at":"2022-09-04T14:38:30.496548Z","updated_at":"2022-09-04T14:38:30.496576Z","structure_string":"Ba2 H8 O12\n1.0\n5.314198 2.437102 -1.350652\n-5.314198 2.437102 1.350652\n-1.253091 0.000000 9.521677\nBa H O\n2 8 12\ndirect\n0.878386 0.878386 0.750000 Ba\n0.121613 0.121613 0.250000 Ba\n0.195277 0.569930 0.680002 H\n0.569930 0.195277 0.819998 H\n0.804722 0.430069 0.319998 H\n0.430069 0.804722 0.180002 H\n0.740907 0.390201 0.480246 H\n0.390202 0.740907 0.019754 H\n0.259092 0.609797 0.519754 H\n0.609798 0.259092 -0.019754 H\n0.498902 0.245453 0.875408 O\n0.245453 0.498902 0.624593 O\n-0.164967 0.426143 0.141927 O\n0.426143 -0.164967 0.358074 O\n0.164967 0.573856 0.858074 O\n0.283569 0.038532 0.575315 O\n-0.038533 0.716431 0.075314 O\n0.716431 -0.038533 0.424686 O\n0.038532 0.283569 0.924686 O\n0.754546 0.501097 0.375408 O\n0.573856 0.164967 0.641927 O\n0.501097 0.754546 0.124593 O\n","nsites":22,"nelements":3,"elements":["Ba","H","O"],"chemical_system":"Ba-H-O","density":3.3067231262450787,"density_atomic":0.09228747055772665,"volume":238.385556208725,"volume_molar":6.525415339271973,"formula_full":"Ba2 H8 O12","formula_reduced":"Ba(H2O3)2","formula_anonymous":"AB4C6","energy_above_hull":2.596869724545454,"spacegroup":15},{"id":"jvasp-56665","created_at":"2022-09-04T14:38:14.677377Z","updated_at":"2022-09-04T14:38:14.677405Z","structure_string":"Mo2 Pb6 Cl4 O10\n1.0\n5.632647 0.000000 0.000000\n-2.816324 6.552494 -0.000000\n0.000000 0.000000 11.130250\nMo Pb Cl O\n2 6 4 10\ndirect\n0.233735 0.467470 0.250000 Mo\n0.766265 0.532530 0.750000 Mo\n0.349456 0.698911 0.532809 Pb\n0.650544 0.301089 0.032809 Pb\n0.349456 0.698911 0.967191 Pb\n0.100802 0.201604 0.750000 Pb\n0.650544 0.301089 0.467191 Pb\n0.899199 0.798395 0.250000 Pb\n0.000000 0.000000 0.000000 Cl\n0.517840 0.035680 0.750000 Cl\n0.482161 0.964319 0.250000 Cl\n0.000000 0.000000 0.500000 Cl\n0.103722 0.207444 0.250000 O\n0.037768 0.541645 0.368839 O\n0.496124 0.458354 0.631161 O\n0.962232 0.458354 0.868839 O\n0.962232 0.458354 0.631161 O\n0.896278 0.792556 0.750000 O\n0.496124 0.458354 0.868839 O\n0.037768 0.541645 0.131161 O\n0.503876 0.541645 0.368839 O\n0.503876 0.541645 0.131161 O\n","nsites":22,"nelements":4,"elements":["Mo","Pb","Cl","O"],"chemical_system":"Cl-Mo-O-Pb","density":7.0209572093805175,"density_atomic":0.05355482381616471,"volume":410.7939944965263,"volume_molar":11.244814810094304,"formula_full":"Mo2 Pb6 Cl4 O10","formula_reduced":"MoPb3Cl2O5","formula_anonymous":"AB2C3D5","energy_above_hull":1.935434908636364,"spacegroup":63},{"id":"jvasp-44434","created_at":"2022-09-04T14:38:05.645123Z","updated_at":"2022-09-04T14:38:05.645145Z","structure_string":"Na2 V2 Si2 C2 O14\n1.0\n0.000000 5.385802 -0.202287\n6.401461 0.000000 0.000000\n0.000000 -0.174690 -8.485385\nNa V Si C O\n2 2 2 2 14\ndirect\n0.851357 0.518100 0.164283 Na\n0.148642 0.018100 0.835718 Na\n0.228023 0.234099 0.337711 V\n0.771976 0.734099 0.662289 V\n0.276453 0.738682 0.433795 Si\n0.723547 0.238682 0.566206 Si\n0.380975 0.258216 0.063095 C\n0.619024 0.758216 0.936906 C\n0.475651 0.769874 0.813742 O\n0.768518 0.454548 0.666737 O\n0.786409 0.038039 0.672142 O\n0.086450 0.749323 0.588179 O\n0.435662 0.244302 0.501805 O\n0.564338 0.744302 0.498196 O\n0.524348 0.269874 0.186259 O\n0.213590 0.538039 0.327859 O\n0.231482 0.954548 0.333264 O\n0.857366 0.739076 0.888298 O\n0.142634 0.239076 0.111703 O\n0.554117 0.757889 0.076907 O\n0.913550 0.249323 0.411822 O\n0.445882 0.257889 0.923094 O\n","nsites":22,"nelements":5,"elements":["Na","V","Si","C","O"],"chemical_system":"C-Na-O-Si-V","density":2.563867176734446,"density_atomic":0.07514255497247885,"volume":292.77684273654995,"volume_molar":8.014287991944943,"formula_full":"Na2 V2 Si2 C2 O14","formula_reduced":"NaVSiCO7","formula_anonymous":"ABCDE7","energy_above_hull":3.069495118181817,"spacegroup":4}]}