HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=4408",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=4406",
"results": [
{
"id": "jvasp-118497",
"created_at": "2022-09-04T14:38:45.112508Z",
"updated_at": "2022-09-04T14:38:45.112524Z",
"structure_string": "Si1 H1 O2\n1.0\n1.358175 0.784143 5.941672\n-1.358175 0.784143 5.941672\n-0.000000 -1.568286 5.941672\nSi H O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Si\n0.499998 0.499998 0.500004 H\n0.282761 0.282761 0.282765 O\n0.717235 0.717235 0.717244 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"H",
"O"
],
"chemical_system": "H-O-Si",
"density": 2.671924736461265,
"density_atomic": 0.10535352358110454,
"volume": 37.967405968350654,
"volume_molar": 5.716126575836794,
"formula_full": "Si1 H1 O2",
"formula_reduced": "SiHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3044814,
"spacegroup": 166
},
{
"id": "jvasp-101928",
"created_at": "2022-09-04T14:36:58.846737Z",
"updated_at": "2022-09-04T14:36:58.846766Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.349340 -0.122238 -1.311284\n-0.408976 5.762268 0.142442\n-0.216346 0.294734 7.655934\nMg H C O\n2 4 6 8\ndirect\n0.932487 0.160898 0.566865 Mg\n0.030616 0.229395 0.008079 Mg\n0.345899 0.603342 0.544064 H\n0.361719 0.786564 0.294557 H\n0.747528 0.663731 0.681504 H\n0.313726 0.704231 0.068283 H\n0.480459 0.716746 0.206957 C\n0.505451 0.653561 0.679880 C\n0.757864 0.886046 0.208413 C\n0.567209 0.475120 0.287254 C\n0.451976 0.473118 0.820152 C\n0.413827 0.894017 0.701004 C\n0.171655 0.377882 0.797249 O\n0.677564 0.420564 0.956699 O\n0.826231 0.454430 0.411029 O\n0.173559 0.909804 0.748026 O\n0.815769 0.931186 0.056310 O\n0.561182 0.074211 0.650885 O\n0.921388 0.974074 0.358643 O\n0.365022 0.303934 0.233101 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"H",
"C",
"O"
],
"chemical_system": "C-H-Mg-O",
"density": 2.2104433488235746,
"density_atomic": 0.10535449060242977,
"volume": 189.83528737728759,
"volume_molar": 5.716074109005386,
"formula_full": "Mg2 H4 C6 O8",
"formula_reduced": "MgH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.714134305,
"spacegroup": 1
},
{
"id": "jvasp-17291",
"created_at": "2022-09-04T14:37:55.446425Z",
"updated_at": "2022-09-04T14:37:55.446444Z",
"structure_string": "Cu1 O1\n1.0\n2.593052 0.000000 1.497099\n0.864351 2.444753 1.497099\n-0.000000 -0.000000 2.994199\nCu O\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.499999 0.500001 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"O"
],
"chemical_system": "Cu-O",
"density": 6.958847076399459,
"density_atomic": 0.10536663750732092,
"volume": 18.98134027349064,
"volume_molar": 5.715415147020877,
"formula_full": "Cu1 O1",
"formula_reduced": "CuO",
"formula_anonymous": "AB",
"energy_above_hull": 0.44612965625,
"spacegroup": 225
},
{
"id": "jvasp-112753",
"created_at": "2022-09-04T14:38:43.370194Z",
"updated_at": "2022-09-04T14:38:43.370231Z",
"structure_string": "Mg8 Fe2 O10\n1.0\n2.982015 0.000092 -0.000241\n-0.000507 12.337891 -1.615350\n0.000432 -0.045351 5.165055\nMg Fe O\n8 2 10\ndirect\n-0.000002 0.202894 0.401009 Mg\n0.499996 0.202890 0.900999 Mg\n-0.000001 0.797108 0.598989 Mg\n0.499996 0.797106 0.098989 Mg\n0.500001 0.401001 0.300352 Mg\n0.000002 0.401000 0.800343 Mg\n0.500001 0.598998 0.699658 Mg\n0.000002 0.599001 0.199670 Mg\n0.000004 -0.000001 0.000014 Fe\n0.499988 0.000000 0.499971 Fe\n0.499999 0.302050 0.600721 O\n0.000002 0.500000 0.500007 O\n0.500002 0.500001 0.000008 O\n0.499999 0.893018 0.797610 O\n-0.000007 0.893013 0.297607 O\n0.499999 0.106987 0.202380 O\n-0.000006 0.106980 0.702379 O\n0.499999 0.697951 0.399284 O\n-0.000000 0.697951 0.899286 O\n0.000000 0.302050 0.100716 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mg",
"Fe",
"O"
],
"chemical_system": "Fe-Mg-O",
"density": 4.077785686829928,
"density_atomic": 0.10536680970595581,
"volume": 189.8130925270817,
"volume_molar": 5.71540580644495,
"formula_full": "Mg8 Fe2 O10",
"formula_reduced": "Mg4FeO5",
"formula_anonymous": "AB4C5",
"energy_above_hull": 1.18493192,
"spacegroup": 166
},
{
"id": "jvasp-119720",
"created_at": "2022-09-04T14:38:52.288574Z",
"updated_at": "2022-09-04T14:38:52.288602Z",
"structure_string": "Li3 Mn5 O10\n1.0\n4.832032 0.005602 -1.007277\n-1.263590 4.623557 -1.804314\n0.051090 -0.035582 7.648920\nLi Mn O\n3 5 10\ndirect\n0.223755 0.927330 0.424302 Li\n0.500000 0.500000 0.500001 Li\n0.776243 0.072669 0.575697 Li\n0.107435 0.695817 0.692384 Mn\n-0.000001 0.500000 -0.000001 Mn\n0.692441 0.883796 0.895288 Mn\n0.307558 0.116206 0.104714 Mn\n0.892566 0.304185 0.307617 Mn\n0.658509 0.264845 0.055137 O\n0.779355 0.530195 0.762408 O\n0.545096 0.126302 0.334856 O\n0.454906 0.873701 0.665144 O\n0.036429 0.069258 0.855336 O\n0.341491 0.735154 0.944862 O\n0.119025 0.317433 0.539086 O\n0.880975 0.682566 0.460913 O\n0.220644 0.469804 0.237593 O\n0.963571 0.930744 0.144666 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.427930297228675,
"density_atomic": 0.10537289537453688,
"volume": 170.82191711654968,
"volume_molar": 5.71507572093842,
"formula_full": "Li3 Mn5 O10",
"formula_reduced": "Li3Mn5O10",
"formula_anonymous": "A3B5C10",
"energy_above_hull": 3.199708400383142,
"spacegroup": 2
},
{
"id": "jvasp-39814",
"created_at": "2022-09-04T14:37:55.636578Z",
"updated_at": "2022-09-04T14:37:55.636605Z",
"structure_string": "Yb2 Be26\n1.0\n0.000000 5.102681 5.102681\n5.102681 -0.000000 5.102681\n5.102681 5.102681 -0.000000\nYb Be\n2 26\ndirect\n0.249999 0.249999 0.249999 Yb\n0.750000 0.750000 0.750000 Yb\n0.210891 0.789110 0.564489 Be\n0.789108 0.435510 0.564491 Be\n0.435510 0.564491 0.789108 Be\n0.435509 0.789109 0.210892 Be\n0.789109 0.210892 0.435509 Be\n0.564489 0.210891 0.789110 Be\n0.564490 0.435511 0.210890 Be\n0.210890 0.564490 0.435511 Be\n0.789110 0.564489 0.210891 Be\n0.564491 0.789108 0.435510 Be\n0.210892 0.435509 0.789109 Be\n0.435511 0.210890 0.564490 Be\n0.710892 0.289109 0.935510 Be\n0.064489 0.710890 0.935512 Be\n0.935512 0.064489 0.710890 Be\n0.710890 0.064489 0.289111 Be\n0.289111 0.710890 0.064489 Be\n0.289109 0.935510 0.710892 Be\n0.064491 0.935510 0.289109 Be\n0.935510 0.289109 0.064491 Be\n0.289109 0.064491 0.935510 Be\n0.064489 0.289111 0.710890 Be\n0.710890 0.935512 0.064489 Be\n0.935510 0.710892 0.289109 Be\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.500000 Be\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Yb",
"Be"
],
"chemical_system": "Be-Yb",
"density": 3.62701042568588,
"density_atomic": 0.10537383336135879,
"volume": 265.7206168440273,
"volume_molar": 5.715024848102712,
"formula_full": "Yb2 Be26",
"formula_reduced": "YbBe13",
"formula_anonymous": "AB13",
"energy_above_hull": 2.0304835714285714,
"spacegroup": 226
},
{
"id": "jvasp-117133",
"created_at": "2022-09-04T14:38:46.328056Z",
"updated_at": "2022-09-04T14:38:46.328074Z",
"structure_string": "Li2 Mn3 Fe1 O8\n1.0\n4.975504 0.035632 2.907328\n1.685363 4.681502 2.907328\n0.050315 0.035632 5.762435\nLi Mn Fe O\n2 3 1 8\ndirect\n0.878782 0.878783 0.878787 Li\n0.503539 0.503539 0.503541 Li\n0.993390 0.501007 0.501010 Mn\n0.501007 0.993390 0.501010 Mn\n0.501007 0.501007 0.993394 Mn\n0.119168 0.119168 0.119168 Fe\n0.738561 0.738562 0.738565 O\n0.748864 0.748864 0.285272 O\n0.748864 0.285270 0.748867 O\n0.285270 0.748864 0.748867 O\n0.728440 0.249018 0.249020 O\n0.249018 0.728440 0.249020 O\n0.249018 0.249018 0.728442 O\n0.255059 0.255059 0.255060 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Fe",
"O"
],
"chemical_system": "Fe-Li-Mn-O",
"density": 4.531233226991242,
"density_atomic": 0.10537651087101237,
"volume": 132.85693257709872,
"volume_molar": 5.714879635150843,
"formula_full": "Li2 Mn3 Fe1 O8",
"formula_reduced": "Li2Mn3FeO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.119149658866995,
"spacegroup": 160
},
{
"id": "jvasp-45907",
"created_at": "2022-09-04T14:38:05.983683Z",
"updated_at": "2022-09-04T14:38:05.983714Z",
"structure_string": "Zn3 Ni7 O10\n1.0\n2.123017 -2.123017 -0.000000\n-2.123017 0.000000 -2.123017\n14.743700 14.743700 -12.620682\nZn Ni O\n3 7 10\ndirect\n0.999392 0.998784 0.998173 Zn\n0.100000 0.200000 0.300000 Zn\n0.200609 0.401217 0.601827 Zn\n0.299010 0.598020 0.897030 Ni\n0.900991 0.801981 0.702970 Ni\n0.500148 0.000294 0.500441 Ni\n0.600001 0.200000 0.800000 Ni\n0.699853 0.399707 0.099559 Ni\n0.399534 0.799070 0.198602 Ni\n0.800467 0.600932 0.401398 Ni\n0.949447 0.898893 0.848338 O\n0.349977 0.699955 0.049931 O\n0.049690 0.099378 0.149069 O\n0.749405 0.498809 0.248213 O\n0.450596 0.901192 0.351787 O\n0.150310 0.300622 0.450931 O\n0.850025 0.700047 0.550069 O\n0.551230 0.102457 0.653687 O\n0.250554 0.501108 0.751662 O\n0.648771 0.297542 0.946313 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Zn",
"Ni",
"O"
],
"chemical_system": "Ni-O-Zn",
"density": 6.711419870798905,
"density_atomic": 0.10537985389528977,
"volume": 189.78959697432217,
"volume_molar": 5.714698338815191,
"formula_full": "Zn3 Ni7 O10",
"formula_reduced": "Zn3Ni7O10",
"formula_anonymous": "A3B7C10",
"energy_above_hull": 1.6380936499999998,
"spacegroup": 166
},
{
"id": "jvasp-99585",
"created_at": "2022-09-04T14:36:33.358367Z",
"updated_at": "2022-09-04T14:36:33.358393Z",
"structure_string": "Cr1 B2 Mo1\n1.0\n4.395747 0.001031 0.000000\n-3.326865 2.873075 0.000000\n0.000000 0.000000 3.004670\nCr B Mo\n1 2 1\ndirect\n0.859004 0.140997 0.500000 Cr\n0.435901 0.564102 -0.000000 B\n0.555665 0.444337 0.500000 B\n0.149436 0.850568 -0.000000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"B",
"Mo"
],
"chemical_system": "B-Cr-Mo",
"density": 7.417768448810864,
"density_atomic": 0.1053818030262504,
"volume": 37.95721732910195,
"volume_molar": 5.7145926403440805,
"formula_full": "Cr1 B2 Mo1",
"formula_reduced": "CrB2Mo",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.816747116666667,
"spacegroup": 38
},
{
"id": "jvasp-46285",
"created_at": "2022-09-04T14:38:10.052019Z",
"updated_at": "2022-09-04T14:38:10.052045Z",
"structure_string": "Li5 Co5 Sn2 O12\n1.0\n5.201083 0.172224 -0.179236\n2.425296 4.604224 0.179236\n-0.789589 1.260709 9.780736\nLi Co Sn O\n5 5 2 12\ndirect\n0.190864 0.687229 0.500974 Li\n0.332003 0.805532 0.993748 Li\n0.687229 0.190863 0.999027 Li\n0.805534 0.332002 0.506253 Li\n0.910307 0.910305 0.750000 Li\n0.096202 0.096202 0.250000 Co\n0.005680 0.499419 0.001945 Co\n0.499419 0.005679 0.498055 Co\n0.407165 0.407164 0.250000 Co\n0.580233 0.580232 0.750000 Co\n0.752381 0.752379 0.250000 Sn\n0.248213 0.248212 0.750000 Sn\n0.797890 0.032183 0.373485 O\n0.941663 0.235288 0.868073 O\n0.235290 0.941662 0.631928 O\n0.126488 0.377443 0.377764 O\n0.377444 0.126487 0.122236 O\n0.309559 0.526969 0.867823 O\n0.526970 0.309558 0.632178 O\n0.466785 0.708272 0.369052 O\n0.708274 0.466783 0.130948 O\n0.621813 0.840417 0.866095 O\n0.840419 0.621811 0.633906 O\n0.032184 0.797889 0.126515 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Co",
"Sn",
"O"
],
"chemical_system": "Co-Li-O-Sn",
"density": 5.532722744931134,
"density_atomic": 0.10538602304998358,
"volume": 227.7341843388191,
"volume_molar": 5.714363808133984,
"formula_full": "Li5 Co5 Sn2 O12",
"formula_reduced": "Li5Co5(SnO6)2",
"formula_anonymous": "A2B5C5D12",
"energy_above_hull": 2.5762741625000003,
"spacegroup": 5
},
{
"id": "jvasp-44667",
"created_at": "2022-09-04T14:38:06.268892Z",
"updated_at": "2022-09-04T14:38:06.268901Z",
"structure_string": "Li2 Mn3 Fe1 O8\n1.0\n-0.020623 4.039537 4.039537\n4.039537 -0.020623 4.039537\n4.039537 4.039537 -0.020623\nLi Mn Fe O\n2 3 1 8\ndirect\n0.123681 0.123681 0.123681 Li\n0.876320 0.876320 0.876320 Li\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500001 0.500001 0.500001 Fe\n0.261455 0.261455 0.261455 O\n0.712160 0.261579 0.261579 O\n0.261579 0.712160 0.261579 O\n0.261579 0.261579 0.712160 O\n0.738423 0.738423 0.287842 O\n0.738423 0.287842 0.738423 O\n0.287842 0.738423 0.738423 O\n0.738546 0.738546 0.738546 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Fe",
"O"
],
"chemical_system": "Fe-Li-Mn-O",
"density": 4.531716900794307,
"density_atomic": 0.10538775899160416,
"volume": 132.84275264943557,
"volume_molar": 5.714269681434028,
"formula_full": "Li2 Mn3 Fe1 O8",
"formula_reduced": "Li2Mn3FeO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.110845373152709,
"spacegroup": 166
},
{
"id": "jvasp-114011",
"created_at": "2022-09-04T14:38:46.907290Z",
"updated_at": "2022-09-04T14:38:46.907313Z",
"structure_string": "B2 O1\n1.0\n4.501941 0.596131 0.367119\n0.954510 -2.151318 -0.133329\n-1.711508 -3.059223 -3.178257\nB O\n2 1\ndirect\n0.489521 0.645874 0.065685 B\n-0.008920 0.801096 0.662926 B\n0.067359 -0.009167 0.941770 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"O"
],
"chemical_system": "B-O",
"density": 2.194591636803251,
"density_atomic": 0.10538794211896838,
"volume": 28.466254674689594,
"volume_molar": 5.714259752032958,
"formula_full": "B2 O1",
"formula_reduced": "B2O",
"formula_anonymous": "AB2",
"energy_above_hull": 3.1872062222222226,
"spacegroup": 8
}
]
}