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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=406",
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"results": [
{
"id": "jvasp-46766",
"created_at": "2022-09-04T14:38:07.706079Z",
"updated_at": "2022-09-04T14:38:07.706108Z",
"structure_string": "Li4 Mn2 Si4 O12\n1.0\n-1.773814 1.582198 4.543495\n-7.532286 -0.360497 0.185043\n0.499184 -7.524367 -0.185044\nLi Mn Si O\n4 2 4 12\ndirect\n0.496756 0.795957 0.584946 Li\n0.250000 0.794785 0.794784 Li\n0.003246 0.584947 0.795958 Li\n0.750001 0.221340 0.221341 Li\n0.750001 0.960680 0.960680 Mn\n0.250000 0.184274 0.184274 Mn\n0.858210 0.777501 0.368567 Si\n0.353054 0.616120 0.198899 Si\n0.641791 0.368566 0.777501 Si\n0.146947 0.198899 0.616120 Si\n0.832807 0.217570 0.978015 O\n0.295112 0.363124 0.702477 O\n0.374194 0.400929 0.166419 O\n0.808319 0.276807 0.625440 O\n0.204889 0.702477 0.363124 O\n0.667194 0.978015 0.217570 O\n0.691682 0.625440 0.276807 O\n0.138648 0.752208 -0.003753 O\n0.878207 0.792528 0.585826 O\n0.125806 0.166419 0.400929 O\n0.621795 0.585825 0.792528 O\n0.361352 -0.003753 0.752207 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 2.8931244043107367,
"density_atomic": 0.08672475780453723,
"volume": 253.67611921827717,
"volume_molar": 6.943969533559119,
"formula_full": "Li4 Mn2 Si4 O12",
"formula_reduced": "Li2Mn(SiO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.6724923128526643,
"spacegroup": 5
},
{
"id": "jvasp-46747",
"created_at": "2022-09-04T14:38:05.047381Z",
"updated_at": "2022-09-04T14:38:05.047409Z",
"structure_string": "Li2 Mn1 Si3 O8\n1.0\n5.007784 0.002340 -0.079936\n1.625821 6.039180 0.043592\n1.854686 1.023054 5.769899\nLi Mn Si O\n2 1 3 8\ndirect\n0.743847 0.857271 0.350192 Li\n0.229258 0.124308 0.675425 Li\n0.373957 0.622466 0.717245 Mn\n0.708661 0.826200 0.885280 Si\n0.659781 0.396403 0.244873 Si\n0.265421 0.186793 0.116889 Si\n0.026473 0.864804 0.842212 O\n0.927650 0.167488 0.240710 O\n0.580660 0.899184 0.658549 O\n0.660290 0.544308 0.422526 O\n0.283868 0.319339 0.856911 O\n0.684842 0.552769 0.981058 O\n0.490471 0.941687 0.111761 O\n0.364823 0.295573 0.297760 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 2.6667909309390283,
"density_atomic": 0.07999276667535066,
"volume": 175.01582432845174,
"volume_molar": 7.5283566380954925,
"formula_full": "Li2 Mn1 Si3 O8",
"formula_reduced": "Li2MnSi3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.8478279315270933,
"spacegroup": 1
},
{
"id": "jvasp-47617",
"created_at": "2022-09-04T14:38:06.044667Z",
"updated_at": "2022-09-04T14:38:06.044678Z",
"structure_string": "Li3 Mn3 Si1 O8\n1.0\n0.000000 5.215427 0.055437\n5.592011 0.000000 0.000000\n0.000000 -2.029956 -4.913195\nLi Mn Si O\n3 3 1 8\ndirect\n0.000000 0.500000 0.000000 Li\n-0.000001 0.244075 0.499999 Li\n-0.000001 0.755925 0.499999 Li\n0.500000 0.249548 -0.000000 Mn\n0.500000 0.750452 -0.000000 Mn\n0.500000 0.500000 0.499999 Mn\n0.500000 0.000000 0.499999 Si\n0.311199 0.000000 0.733413 O\n0.721934 0.236945 0.702104 O\n0.261427 0.500000 0.786719 O\n0.278065 0.236945 0.297894 O\n0.721934 0.763055 0.702104 O\n0.688801 0.000000 0.266586 O\n0.738572 0.500000 0.213279 O\n0.278065 0.763055 0.297894 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.977464801470108,
"density_atomic": 0.10514312010086936,
"volume": 142.66268668467995,
"volume_molar": 5.7275652027661375,
"formula_full": "Li3 Mn3 Si1 O8",
"formula_reduced": "Li3Mn3SiO8",
"formula_anonymous": "AB3C3D8",
"energy_above_hull": 2.9404312216091952,
"spacegroup": 10
},
{
"id": "jvasp-45808",
"created_at": "2022-09-04T14:38:08.030190Z",
"updated_at": "2022-09-04T14:38:08.030217Z",
"structure_string": "Li4 Mn2 Si4 O12\n1.0\n2.906680 4.870972 0.135227\n-2.906680 4.870972 -0.135227\n-0.168183 0.000000 9.269872\nLi Mn Si O\n4 2 4 12\ndirect\n0.598965 0.718746 0.880243 Li\n0.281254 0.401035 0.380243 Li\n0.718747 0.598964 0.619756 Li\n0.401035 0.281253 0.119756 Li\n0.252131 0.252130 0.750000 Mn\n0.747870 0.747869 0.250000 Mn\n0.136671 0.796773 0.632413 Si\n0.203227 0.863329 0.132413 Si\n0.796773 0.136670 0.867587 Si\n0.863329 0.203226 0.367587 Si\n0.761217 0.513087 0.417011 O\n0.486913 0.238782 0.917011 O\n0.000000 0.000000 0.000000 O\n0.120122 0.120122 0.250000 O\n0.000000 -0.000000 0.500000 O\n0.368149 0.851449 0.704766 O\n0.513087 0.761217 0.082989 O\n0.238783 0.486912 0.582989 O\n0.148550 0.631851 0.204766 O\n0.851450 0.368148 0.795234 O\n0.879878 0.879877 0.750000 O\n0.631852 0.148550 0.295234 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 2.7935965669080702,
"density_atomic": 0.0837412955031254,
"volume": 262.7138721442268,
"volume_molar": 7.1913632620780765,
"formula_full": "Li4 Mn2 Si4 O12",
"formula_reduced": "Li2Mn(SiO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.672598676489028,
"spacegroup": 15
},
{
"id": "jvasp-46809",
"created_at": "2022-09-04T14:38:07.321188Z",
"updated_at": "2022-09-04T14:38:07.321215Z",
"structure_string": "Li2 Mn2 Si4 O12\n1.0\n6.591473 0.048008 -0.014331\n-0.691946 6.555230 0.014331\n-1.420654 1.269255 4.943292\nLi Mn Si O\n2 2 4 12\ndirect\n0.241550 0.241550 0.250000 Li\n0.758449 0.758451 0.750000 Li\n0.104632 0.104633 0.750000 Mn\n0.895367 0.895368 0.250000 Mn\n0.208730 0.610230 0.759066 Si\n0.389771 0.791270 0.259066 Si\n0.610229 0.208731 0.740934 Si\n0.791270 0.389771 0.240934 Si\n0.797793 0.029429 0.863979 O\n0.659759 0.370914 0.468450 O\n0.626242 0.887422 0.345181 O\n0.629087 0.340242 0.968450 O\n0.370913 0.659759 0.031550 O\n0.112578 0.373758 0.845181 O\n0.340241 0.629087 0.531549 O\n0.202206 0.970572 0.136021 O\n0.887421 0.626243 0.154818 O\n0.029428 0.797794 0.636021 O\n0.373757 0.112579 0.654818 O\n0.970572 0.202207 0.363979 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.3293397818015933,
"density_atomic": 0.09367010421876265,
"volume": 213.51529569446006,
"volume_molar": 6.429095825425303,
"formula_full": "Li2 Mn2 Si4 O12",
"formula_reduced": "LiMn(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.819555544137931,
"spacegroup": 15
},
{
"id": "jvasp-48582",
"created_at": "2022-09-04T14:36:43.680321Z",
"updated_at": "2022-09-04T14:36:43.680335Z",
"structure_string": "Li6 Mn5 Sb1 O12\n1.0\n2.464886 -4.635380 -0.201494\n-5.248558 -0.122642 -0.201494\n-0.428128 -0.731782 -10.321360\nLi Mn Sb O\n6 5 1 12\ndirect\n0.593014 0.926438 0.288018 Li\n0.741434 0.741434 0.716375 Li\n0.073564 0.406992 0.711984 Li\n0.926438 0.593014 0.288018 Li\n0.258569 0.258569 0.283624 Li\n0.406992 0.073565 0.711984 Li\n0.164672 0.835328 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.835328 0.164672 0.500000 Mn\n0.333395 0.666605 -0.000000 Mn\n0.666605 0.333395 -0.000000 Mn\n0.000000 0.000000 0.000000 Sb\n0.339391 0.009638 0.893245 O\n0.990362 0.660609 0.106754 O\n0.430234 0.755132 0.613417 O\n0.906994 0.906994 0.382894 O\n0.244868 0.569765 0.386583 O\n0.705068 0.705068 0.901424 O\n0.294932 0.294932 0.098575 O\n0.755132 0.430235 0.613417 O\n0.093005 0.093006 0.617105 O\n0.569765 0.244868 0.386583 O\n0.009637 0.339391 0.893245 O\n0.660609 0.990362 0.106754 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.14039229525494,
"density_atomic": 0.09497334207563343,
"volume": 252.70248972482452,
"volume_molar": 6.3408748480222785,
"formula_full": "Li6 Mn5 Sb1 O12",
"formula_reduced": "Li6Mn5SbO12",
"formula_anonymous": "AB5C6D12",
"energy_above_hull": 2.8929785127873564,
"spacegroup": 12
},
{
"id": "jvasp-48235",
"created_at": "2022-09-04T14:36:10.060577Z",
"updated_at": "2022-09-04T14:36:10.060602Z",
"structure_string": "Li2 Mn3 Sb1 O8\n1.0\n5.939349 0.011076 -0.002529\n0.000556 5.932936 0.047633\n-2.965323 -2.758085 4.409937\nLi Mn Sb O\n2 3 1 8\ndirect\n0.500027 0.000041 0.500041 Li\n0.000026 0.000077 0.500050 Li\n0.500000 -0.000020 0.000001 Mn\n0.499979 0.499991 0.499964 Mn\n-0.000037 0.499996 0.499924 Mn\n0.000000 -0.000035 -0.000001 Sb\n0.294230 0.752609 0.564598 O\n0.268862 0.790270 0.020085 O\n0.763444 0.802119 0.042324 O\n0.241102 0.256071 0.459268 O\n0.758885 0.743928 0.540725 O\n0.236561 0.197862 0.957703 O\n0.731157 0.209701 0.979923 O\n0.705771 0.247391 0.435396 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.556827726245291,
"density_atomic": 0.08966852955284754,
"volume": 156.13058527684322,
"volume_molar": 6.7160025819880955,
"formula_full": "Li2 Mn3 Sb1 O8",
"formula_reduced": "Li2Mn3SbO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.9633382731527096,
"spacegroup": 2
},
{
"id": "jvasp-42959",
"created_at": "2022-09-04T14:35:54.893033Z",
"updated_at": "2022-09-04T14:35:54.893064Z",
"structure_string": "Li4 Mn3 Sb1 O8\n1.0\n6.027577 -0.012922 -0.011768\n2.876177 5.297330 -0.011743\n2.879935 1.709712 5.012933\nLi Mn Sb O\n4 3 1 8\ndirect\n0.500001 0.500000 0.500000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 -0.000000 Li\n0.000001 -0.000000 0.500000 Li\n0.500001 0.000000 0.499999 Mn\n0.000001 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Sb\n0.265025 0.265090 0.265216 O\n0.763672 0.230520 0.763699 O\n0.230515 0.763691 0.763712 O\n0.734977 0.734910 0.734783 O\n0.763630 0.763634 0.230543 O\n0.236330 0.769481 0.236301 O\n0.769487 0.236309 0.236287 O\n0.236372 0.236366 0.769456 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.576605510762762,
"density_atomic": 0.09969300676225823,
"volume": 160.4927017414152,
"volume_molar": 6.040685255246871,
"formula_full": "Li4 Mn3 Sb1 O8",
"formula_reduced": "Li4Mn3SbO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.7242547390086203,
"spacegroup": 166
},
{
"id": "jvasp-42911",
"created_at": "2022-09-04T14:35:54.899527Z",
"updated_at": "2022-09-04T14:35:54.899555Z",
"structure_string": "Li2 Mn2 Sb2 O8\n1.0\n6.120307 -0.000000 -0.000000\n3.060154 5.478019 0.041145\n3.060154 1.864797 5.151011\nLi Mn Sb O\n2 2 2 8\ndirect\n0.147681 0.102319 0.102319 Li\n0.852318 0.897682 0.897680 Li\n-0.000001 0.500001 0.499999 Mn\n0.500000 0.500001 0.499999 Mn\n0.500000 0.000000 0.500000 Sb\n0.500000 0.500000 -0.000000 Sb\n0.275973 0.248777 0.248777 O\n0.277262 0.242510 0.702965 O\n0.277262 0.702966 0.242509 O\n0.726471 0.248777 0.248777 O\n0.273528 0.751223 0.751221 O\n0.722737 0.757491 0.297034 O\n0.722737 0.297035 0.757490 O\n0.724026 0.751223 0.751221 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.775153146315717,
"density_atomic": 0.08128704491746554,
"volume": 172.22916658140105,
"volume_molar": 7.408487743790607,
"formula_full": "Li2 Mn2 Sb2 O8",
"formula_reduced": "LiMnSbO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.3986867630541875,
"spacegroup": 74
},
{
"id": "jvasp-113244",
"created_at": "2022-09-04T14:38:47.649118Z",
"updated_at": "2022-09-04T14:38:47.649145Z",
"structure_string": "Li6 Mn5 Sb1 O12\n1.0\n5.233012 0.025341 0.366565\n-2.383793 4.658603 0.366565\n0.117639 0.193392 10.368761\nLi Mn Sb O\n6 5 1 12\ndirect\n0.406023 0.072045 0.711836 Li\n0.259997 0.259997 0.283654 Li\n0.927954 0.593976 0.288165 Li\n0.072045 0.406023 0.711836 Li\n0.740003 0.740002 0.716347 Li\n0.593977 0.927954 0.288165 Li\n0.834967 0.165032 0.500000 Mn\n0.500000 0.499999 0.500000 Mn\n0.165033 0.834966 0.500000 Mn\n0.666547 0.333453 0.000000 Mn\n0.333453 0.666546 0.000000 Mn\n0.000000 0.000000 0.000000 Sb\n0.660492 0.991095 0.106724 O\n0.008905 0.339507 0.893276 O\n0.572440 0.246129 0.386414 O\n0.090687 0.090687 0.616581 O\n0.753870 0.427559 0.613587 O\n0.295516 0.295516 0.098355 O\n0.704484 0.704483 0.901646 O\n0.246129 0.572440 0.386414 O\n0.909313 0.909312 0.383420 O\n0.427559 0.753870 0.613587 O\n0.991095 0.660492 0.106724 O\n0.339508 0.008904 0.893276 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.141060746985928,
"density_atomic": 0.09498867518669658,
"volume": 252.66169838487508,
"volume_molar": 6.339851301393261,
"formula_full": "Li6 Mn5 Sb1 O12",
"formula_reduced": "Li6Mn5SbO12",
"formula_anonymous": "AB5C6D12",
"energy_above_hull": 2.892117679454022,
"spacegroup": 12
},
{
"id": "jvasp-112762",
"created_at": "2022-09-04T14:38:43.462168Z",
"updated_at": "2022-09-04T14:38:43.462192Z",
"structure_string": "Li4 Mn6 Sb2 O16\n1.0\n5.754155 0.000267 0.000036\n-0.000272 5.967470 0.230397\n-0.000062 0.107298 8.922018\nLi Mn Sb O\n4 6 2 16\ndirect\n0.000007 0.247669 0.136494 Li\n0.499994 0.747662 0.636491 Li\n-0.000005 0.752333 0.863507 Li\n0.500004 0.252339 0.363510 Li\n0.249964 0.750007 0.249980 Mn\n-0.000001 0.500000 0.500002 Mn\n0.750040 0.249994 0.750020 Mn\n0.749961 0.749999 0.250019 Mn\n0.500004 0.000001 0.000000 Mn\n0.250039 0.250002 0.749981 Mn\n-0.000002 -0.000000 0.500002 Sb\n0.500001 0.500001 -0.000001 Sb\n-0.000032 0.972624 0.267092 O\n0.728306 0.758599 -0.003309 O\n0.228310 0.258602 0.496690 O\n0.499968 0.527378 0.232908 O\n0.000032 0.027377 0.732907 O\n0.500033 0.472622 0.767093 O\n0.271695 0.241401 0.003310 O\n0.500026 0.033724 0.779947 O\n0.728313 0.241396 0.003311 O\n0.228305 0.741398 0.503310 O\n0.499975 0.966277 0.220055 O\n0.000025 0.466276 0.720054 O\n0.771694 0.258603 0.496691 O\n-0.000025 0.533723 0.279946 O\n0.771690 0.741399 0.503310 O\n0.271690 0.758604 0.996690 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.64672952708363,
"density_atomic": 0.09143760285770325,
"volume": 306.2197512283221,
"volume_molar": 6.586065876389781,
"formula_full": "Li4 Mn6 Sb2 O16",
"formula_reduced": "Li2Mn3SbO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.956231130295567,
"spacegroup": 12
},
{
"id": "jvasp-111982",
"created_at": "2022-09-04T14:38:53.754326Z",
"updated_at": "2022-09-04T14:38:53.754352Z",
"structure_string": "Li4 Mn4 Sb4 O16\n1.0\n6.256732 0.000020 -0.000035\n0.000021 6.122209 -0.000025\n-0.000051 -0.000033 8.991886\nLi Mn Sb O\n4 4 4 16\ndirect\n0.000000 0.250000 0.102130 Li\n0.500000 0.750000 0.602130 Li\n-0.000001 0.750000 0.897870 Li\n0.499999 0.250000 0.397869 Li\n0.500000 0.000001 0.000000 Mn\n0.000001 0.000001 0.499999 Mn\n0.000001 0.500001 0.500001 Mn\n0.500000 0.500001 -0.000002 Mn\n0.250001 0.250000 0.749999 Sb\n0.749999 0.749999 0.249998 Sb\n0.749999 0.250000 0.750001 Sb\n0.250000 0.749999 0.250000 Sb\n0.269463 0.750001 0.027391 O\n0.769463 0.250001 0.527391 O\n0.269465 0.250001 0.972609 O\n0.769465 0.750000 0.472608 O\n0.730536 0.250000 0.972608 O\n0.230536 0.749999 0.472608 O\n0.499998 0.975162 0.251169 O\n0.500002 0.024837 0.748831 O\n0.500002 0.524838 0.251170 O\n0.000003 0.024838 0.751171 O\n0.499997 0.475162 0.748829 O\n-0.000003 0.975161 0.248829 O\n0.230534 0.250001 0.527392 O\n0.000002 0.524837 0.248830 O\n-0.000002 0.475163 0.751170 O\n0.730534 0.750000 0.027392 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.775485203630009,
"density_atomic": 0.08129269750220885,
"volume": 344.43438168894806,
"volume_molar": 7.407972603980042,
"formula_full": "Li4 Mn4 Sb4 O16",
"formula_reduced": "LiMnSbO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.398678191625616,
"spacegroup": 74
}
]
}