{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=47","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=45","results":[{"id":"jvasp-27257","created_at":"2022-09-04T14:37:50.815143Z","updated_at":"2022-09-04T14:37:50.815169Z","structure_string":"Fe2 Te2 Br14\n1.0\n6.747238 0.044797 -0.054240\n1.047412 8.690964 -0.023398\n2.309778 0.636040 10.070773\nFe Te Br\n2 2 14\ndirect\n0.498154 0.121204 0.119586 Fe\n0.769614 0.548329 0.557159 Fe\n0.951011 0.505446 0.082359 Te\n0.192978 0.936123 0.543699 Te\n0.331306 0.185594 0.572099 Br\n0.739196 0.340285 0.708199 Br\n0.670500 0.483974 0.364100 Br\n0.556952 0.762477 0.654758 Br\n0.113719 0.604399 0.501571 Br\n0.640650 0.626859 -0.005815 Br\n0.067575 0.756904 0.129627 Br\n0.975755 0.919966 0.776291 Br\n0.407130 0.050560 0.933998 Br\n0.492681 0.905064 0.275538 Br\n0.285854 0.332760 0.219557 Br\n0.843583 0.175865 0.065573 Br\n0.192947 0.476891 0.859287 Br\n0.910803 0.050599 0.424907 Br\n","nsites":18,"nelements":3,"elements":["Fe","Te","Br"],"chemical_system":"Br-Fe-Te","density":4.172342801467652,"density_atomic":0.030445091693269255,"volume":591.2283063998591,"volume_molar":19.780333791313115,"formula_full":"Fe2 Te2 Br14","formula_reduced":"FeTeBr7","formula_anonymous":"ABC7","energy_above_hull":0.4492891112962965,"spacegroup":1},{"id":"jvasp-48652","created_at":"2022-09-04T14:37:51.257482Z","updated_at":"2022-09-04T14:37:51.257508Z","structure_string":"Li7 V1 O5 F1\n1.0\n4.947642 0.061414 0.787391\n-2.413202 4.350716 -0.925570\n0.770991 -3.491585 6.509564\nLi V O F\n7 1 5 1\ndirect\n0.212687 0.384888 0.452521 Li\n0.416688 0.578322 0.207364 Li\n0.265772 0.694868 -0.070968 Li\n0.928634 0.576430 0.200418 Li\n0.436783 0.056685 0.706522 Li\n0.956104 0.026441 0.640183 Li\n0.731330 0.323249 0.429282 Li\n0.845074 0.829988 -0.099221 V\n0.166400 0.746903 0.442280 O\n0.144353 0.267347 0.941475 O\n0.564399 0.726318 0.720825 O\n0.829705 0.878706 0.164491 O\n0.890594 0.406204 0.700036 O\n0.507076 0.253153 0.212290 F\n","nsites":14,"nelements":4,"elements":["Li","V","O","F"],"chemical_system":"F-Li-O-V","density":2.5545207477388394,"density_atomic":0.10848646729385895,"volume":129.04835367233395,"volume_molar":5.551052504721842,"formula_full":"Li7 V1 O5 F1","formula_reduced":"Li7VO5F","formula_anonymous":"ABC5D7","energy_above_hull":1.70030799875,"spacegroup":1},{"id":"jvasp-29971","created_at":"2022-09-04T14:37:51.329498Z","updated_at":"2022-09-04T14:37:51.329528Z","structure_string":"Ag2 Cl2 O4\n1.0\n4.790824 -0.014312 2.673276\n0.239565 4.582444 7.571795\n0.653620 0.852258 7.036303\nAg Cl O\n2 2 4\ndirect\n0.657415 0.719621 0.250353 Ag\n0.466950 0.934056 0.576028 Ag\n0.145411 0.167368 0.827925 Cl\n0.985991 0.375738 0.103412 Cl\n0.312482 0.231126 0.074547 O\n0.143942 0.160238 0.611792 O\n0.780411 0.809930 0.387577 O\n0.533429 0.586080 0.172660 O\n","nsites":8,"nelements":3,"elements":["Ag","Cl","O"],"chemical_system":"Ag-Cl-O","density":5.01728281752267,"density_atomic":0.0689363070278177,"volume":116.04915239761509,"volume_molar":8.735804135214119,"formula_full":"Ag2 Cl2 O4","formula_reduced":"AgClO2","formula_anonymous":"ABC2","energy_above_hull":1.183987081875,"spacegroup":1},{"id":"jvasp-42725","created_at":"2022-09-04T14:37:51.375402Z","updated_at":"2022-09-04T14:37:51.375427Z","structure_string":"Li3 Fe2 Si2 O8\n1.0\n4.952505 -0.106895 -0.016322\n-0.134408 5.253843 0.051472\n-0.112964 -0.081643 6.545040\nLi Fe Si O\n3 2 2 8\ndirect\n0.493194 0.158877 0.506456 Li\n0.504645 0.650495 0.278352 Li\n0.996260 0.846854 0.508871 Li\n0.487365 0.171431 0.991486 Fe\n0.025973 0.819201 0.000504 Fe\n-0.006303 0.325372 0.263819 Si\n0.492634 0.670349 0.736800 Si\n0.113694 0.182957 0.456509 O\n0.099526 0.185749 0.049272 O\n0.656388 0.310042 0.242718 O\n0.554608 0.367344 0.757171 O\n0.100130 0.631404 0.245325 O\n0.166996 0.719843 0.752326 O\n0.622317 0.819497 0.953801 O\n0.608959 0.801482 0.531300 O\n","nsites":15,"nelements":4,"elements":["Li","Fe","Si","O"],"chemical_system":"Fe-Li-O-Si","density":3.0893326811706063,"density_atomic":0.08812259978034652,"volume":170.2174020896892,"volume_molar":6.8338210345708434,"formula_full":"Li3 Fe2 Si2 O8","formula_reduced":"Li3Fe2(SiO4)2","formula_anonymous":"A2B2C3D8","energy_above_hull":2.70839708,"spacegroup":1},{"id":"jvasp-101978","created_at":"2022-09-04T14:37:51.400936Z","updated_at":"2022-09-04T14:37:51.400961Z","structure_string":"H12 Pb1 C8 O4\n1.0\n3.923134 -0.089140 -0.367774\n-0.738019 4.298334 -0.126764\n-0.465087 -0.064299 13.092116\nH Pb C O\n12 1 8 4\ndirect\n0.534230 0.273074 0.567060 H\n0.085086 0.111352 0.560451 H\n0.081375 0.155365 0.161089 H\n0.653471 0.106004 0.193539 H\n0.405852 0.724505 0.468357 H\n0.347448 0.220436 0.359274 H\n0.231836 0.681428 0.262046 H\n0.802871 0.623384 0.292900 H\n0.994463 0.638181 0.067644 H\n0.575148 0.602440 0.104367 H\n-0.041493 0.624528 0.480507 H\n0.906115 0.120616 0.377936 H\n-0.005572 0.876777 0.826367 Pb\n0.261024 0.502821 0.666173 C\n0.274021 0.333116 0.565086 C\n0.190786 0.523576 0.471455 C\n0.117449 0.322166 0.370750 C\n0.010384 0.497812 0.276278 C\n0.878834 0.284142 0.179192 C\n0.771663 0.466346 0.086163 C\n0.608055 0.262673 0.990466 C\n0.047005 0.376741 0.725419 O\n0.446570 0.775304 0.688733 O\n0.688015 0.346541 0.901642 O\n0.391761 0.012634 -0.000386 O\n","nsites":25,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":2.875007763954805,"density_atomic":0.1140925379228939,"volume":219.12037767882347,"volume_molar":5.278295031064949,"formula_full":"H12 Pb1 C8 O4","formula_reduced":"H12Pb(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.5315517928,"spacegroup":1},{"id":"jvasp-43672","created_at":"2022-09-04T14:37:51.591814Z","updated_at":"2022-09-04T14:37:51.591846Z","structure_string":"Li1 V4 O1 F11\n1.0\n5.034133 0.014899 -0.006583\n-0.058391 5.400064 -0.058766\n-0.054991 -0.658983 7.398857\nLi V O F\n1 4 1 11\ndirect\n0.001601 0.590119 0.192808 Li\n0.001724 0.004182 0.505814 V\n0.504081 0.498831 0.502902 V\n0.481922 0.485822 0.997524 V\n0.007784 0.023040 0.001058 V\n0.197208 0.302993 0.050744 O\n0.296697 0.799647 0.077100 F\n0.315917 0.185289 0.438034 F\n0.370525 0.508306 0.747785 F\n0.645655 0.492872 0.248758 F\n0.815494 0.684379 0.958191 F\n0.685842 0.183296 0.926252 F\n0.178606 0.677038 0.423520 F\n0.820206 0.318395 0.566801 F\n0.876473 0.993476 0.250424 F\n0.685882 0.815762 0.558841 F\n0.129354 0.983146 0.750843 F\n","nsites":17,"nelements":4,"elements":["Li","V","O","F"],"chemical_system":"F-Li-O-V","density":3.600387160566057,"density_atomic":0.084600435210237,"volume":200.94459275243693,"volume_molar":7.11833307362383,"formula_full":"Li1 V4 O1 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0.171878 O\n0.603573 0.924606 0.350475 F\n0.617621 0.327039 0.413989 F\n0.134563 0.836964 0.908545 F\n","nsites":24,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":5.087214246296895,"density_atomic":0.10436773265513304,"volume":229.9561309749276,"volume_molar":5.770117455650042,"formula_full":"Mn8 O13 F3","formula_reduced":"Mn8O13F3","formula_anonymous":"A3B8C13","energy_above_hull":3.3645214282722704,"spacegroup":1},{"id":"jvasp-49939","created_at":"2022-09-04T14:37:52.308173Z","updated_at":"2022-09-04T14:37:52.308191Z","structure_string":"Hf8 N8 O4\n1.0\n5.402064 -0.002886 0.001207\n0.006363 6.449631 0.000894\n0.038930 1.602346 6.797330\nHf N O\n8 8 4\ndirect\n0.712248 0.870702 0.151123 Hf\n0.702073 0.371072 0.152654 Hf\n0.197625 0.322644 0.346692 Hf\n0.214523 0.821795 0.343084 Hf\n0.770054 0.504921 0.609978 Hf\n0.765804 0.008078 0.606012 Hf\n0.309979 0.692758 0.867774 Hf\n0.275316 0.184919 0.894895 Hf\n0.546023 0.431768 0.866851 N\n0.548624 0.952781 0.865011 N\n0.042719 0.247890 0.637756 N\n0.522490 0.773995 0.528230 N\n0.422717 0.108466 0.193755 N\n0.925902 0.582916 0.312261 N\n0.428895 0.616309 0.179746 N\n0.924712 0.079900 0.308005 N\n0.057904 0.901464 -0.001421 O\n0.553215 0.288438 0.490397 O\n0.025060 0.748551 0.644765 O\n0.054105 0.414399 0.002430 O\n","nsites":20,"nelements":3,"elements":["Hf","N","O"],"chemical_system":"Hf-N-O","density":11.24675438660224,"density_atomic":0.08445231190269753,"volume":236.82004138670797,"volume_molar":7.130818120098906,"formula_full":"Hf8 N8 O4","formula_reduced":"Hf2N2O","formula_anonymous":"AB2C2","energy_above_hull":4.5643432,"spacegroup":1},{"id":"jvasp-9338","created_at":"2022-09-04T14:37:53.816348Z","updated_at":"2022-09-04T14:37:53.816368Z","structure_string":"Al1 Cr1 W2 O8\n1.0\n-4.886746 -0.040198 0.037358\n1.759949 5.384812 0.024822\n-0.435832 -2.578112 -5.846496\nAl Cr W O\n1 1 2 8\ndirect\n0.459509 0.091448 0.596866 Al\n0.974293 0.094711 0.213939 Cr\n0.716537 0.600544 0.401098 W\n0.239518 0.594854 0.060681 W\n0.640353 0.887703 0.646069 O\n0.732467 0.321089 0.490468 O\n0.631021 0.793371 0.200774 O\n0.857989 0.390768 0.094937 O\n0.162051 0.839216 0.980616 O\n0.318756 0.336247 0.800096 O\n0.329474 0.404403 0.279266 O\n0.138130 0.841739 0.413691 O\n","nsites":12,"nelements":4,"elements":["Al","Cr","W","O"],"chemical_system":"Al-Cr-O-W","density":6.23526433028316,"density_atomic":0.07841180684441573,"volume":153.03817732207514,"volume_molar":7.68014537906147,"formula_full":"Al1 Cr1 W2 O8","formula_reduced":"AlCr(WO4)2","formula_anonymous":"ABC2D8","energy_above_hull":4.040124016666668,"spacegroup":1},{"id":"jvasp-51707","created_at":"2022-09-04T14:37:54.246343Z","updated_at":"2022-09-04T14:37:54.246376Z","structure_string":"Li8 H12 Os2\n1.0\n4.076941 2.353823 3.333973\n-4.076941 2.353823 3.333973\n-0.000000 -4.707646 3.333973\nLi H Os\n8 12 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.749999 0.750000 Li\n0.638133 0.861865 0.250000 Li\n0.861865 0.249999 0.638134 Li\n0.249999 0.638133 0.861866 Li\n0.138134 0.749999 0.361866 Li\n0.749999 0.361865 0.138134 Li\n0.361865 0.138134 0.750000 Li\n0.292509 0.953809 0.055563 H\n0.055562 0.292509 0.953810 H\n0.953809 0.055562 0.292509 H\n0.555562 0.453808 0.792510 H\n0.792508 0.555562 0.453810 H\n0.453808 0.792508 0.555563 H\n0.444437 0.546190 0.207491 H\n0.944436 0.707490 0.046191 H\n0.046190 0.944436 0.707491 H\n0.499999 0.499999 0.500000 H\n0.207490 0.444436 0.546191 H\n0.546190 0.207490 0.444437 H\n0.707490 0.046190 0.944437 Os\n0.000000 0.000000 0.000000 Os\n","nsites":22,"nelements":3,"elements":["Li","H","Os"],"chemical_system":"H-Li-Os","density":3.8760224042654077,"density_atomic":0.11460435554307241,"volume":191.96478088244749,"volume_molar":5.2547224156211625,"formula_full":"Li8 H12 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O\n","nsites":14,"nelements":4,"elements":["Li","V","Ga","O"],"chemical_system":"Ga-Li-O-V","density":3.634584302125497,"density_atomic":0.07622912241013888,"volume":183.65684343937727,"volume_molar":7.9000525909229475,"formula_full":"Li2 V1 Ga3 O8","formula_reduced":"Li2VGa3O8","formula_anonymous":"AB2C3D8","energy_above_hull":1.9400156553571437,"spacegroup":1},{"id":"jvasp-9874","created_at":"2022-09-04T14:37:56.509355Z","updated_at":"2022-09-04T14:37:56.509379Z","structure_string":"Ca4 Al2 Sn2 O10\n1.0\n5.579972 -0.050404 0.131727\n-0.169970 6.009014 0.180175\n-2.421309 -2.754826 7.146242\nCa Al Sn O\n4 2 2 10\ndirect\n0.171085 0.710704 0.280817 Ca\n0.439907 0.890343 0.773690 Ca\n0.881894 0.316893 0.756232 Ca\n0.668047 0.066369 0.272085 Ca\n0.278524 0.337594 0.512362 Al\n0.778205 0.662310 0.486419 Al\n0.509932 0.488546 0.004656 Sn\n0.039488 0.018694 0.001193 Sn\n0.217604 0.379266 0.079476 O\n0.345266 0.806576 0.056019 O\n0.654588 0.929133 0.568030 O\n0.105574 0.100999 0.309131 O\n0.585915 0.414810 0.491291 O\n0.756505 0.671560 0.265012 O\n0.106689 0.596259 0.542539 O\n0.680402 0.192612 0.016249 O\n0.287378 0.266578 0.714082 O\n0.730769 0.646272 0.897204 O\n","nsites":18,"nelements":4,"elements":["Ca","Al","Sn","O"],"chemical_system":"Al-Ca-O-Sn","density":4.157337985679687,"density_atomic":0.07367294244952355,"volume":244.32307712336265,"volume_molar":8.174155340851256,"formula_full":"Ca4 Al2 Sn2 O10","formula_reduced":"Ca2AlSnO5","formula_anonymous":"ABC2D5","energy_above_hull":1.4414314266666666,"spacegroup":1}]}