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=-formula_reduced&page=3797",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=3795",
"results": [
{
"id": "jvasp-68306",
"created_at": "2022-09-04T14:36:00.687141Z",
"updated_at": "2022-09-04T14:36:00.687167Z",
"structure_string": "Ca1 Mg1 Be1\n1.0\n2.319182 -4.016939 -0.000000\n2.319182 4.016939 0.000000\n0.000000 0.000000 3.734721\nCa Mg Be\n1 1 1\ndirect\n0.666667 0.333333 0.333331 Ca\n0.333333 0.666667 0.833355 Mg\n0.000000 -0.000000 0.833315 Be\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Be"
],
"chemical_system": "Be-Ca-Mg",
"density": 1.7514527335970498,
"density_atomic": 0.04311248209665808,
"volume": 69.58541596547393,
"volume_molar": 13.968438992907844,
"formula_full": "Ca1 Mg1 Be1",
"formula_reduced": "CaMgBe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2542571208333333,
"spacegroup": 187
},
{
"id": "jvasp-10075",
"created_at": "2022-09-04T14:38:13.525105Z",
"updated_at": "2022-09-04T14:38:13.525146Z",
"structure_string": "Ca2 Mg2 As2 O8 F2\n1.0\n5.474670 -0.007016 -1.337521\n-1.966809 5.109180 -1.337521\n-0.012334 -0.017940 7.115142\nCa Mg As O F\n2 2 2 8 2\ndirect\n0.167708 0.332292 0.250000 Ca\n0.832293 0.667707 0.750000 Ca\n0.500000 -0.000000 -0.000000 Mg\n0.500000 -0.000000 0.500000 Mg\n0.821166 0.678833 0.250000 As\n0.178834 0.321166 0.750000 As\n0.759716 0.381335 0.073932 O\n0.118664 0.740284 0.426068 O\n0.171143 0.099803 0.881166 O\n0.400197 0.328857 0.618833 O\n0.828857 0.900196 0.118833 O\n0.599803 0.671142 0.381167 O\n0.240284 0.618664 0.926068 O\n0.881336 0.259716 0.573932 O\n0.417973 0.082027 0.250000 F\n0.582027 0.917973 0.750000 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ca",
"Mg",
"As",
"O",
"F"
],
"chemical_system": "As-Ca-F-Mg-O",
"density": 3.7163431797545194,
"density_atomic": 0.08054082238741084,
"volume": 198.65702293227298,
"volume_molar": 7.477128469129349,
"formula_full": "Ca2 Mg2 As2 O8 F2",
"formula_reduced": "CaMgAsO4F",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 1.1980019378125,
"spacegroup": 15
},
{
"id": "jvasp-96682",
"created_at": "2022-09-04T14:35:44.577903Z",
"updated_at": "2022-09-04T14:35:44.577925Z",
"structure_string": "Ca2 Mg2 As2 O8 F2\n1.0\n5.474204 -0.007128 -1.337167\n-1.966747 5.108705 -1.337167\n-0.012221 -0.017776 7.113759\nCa Mg As O F\n2 2 2 8 2\ndirect\n0.835911 0.671225 0.750974 Ca\n0.171225 0.335912 0.250974 Ca\n0.503551 0.003569 0.000969 Mg\n0.503569 0.003551 0.500969 Mg\n0.824702 0.682427 0.250975 As\n0.182426 0.324703 0.750976 As\n0.243849 0.622178 0.927104 O\n0.603304 0.674702 0.382149 O\n0.832423 0.903837 0.119811 O\n0.763250 0.384948 0.074840 O\n0.174702 0.103304 0.882150 O\n0.403836 0.332423 0.619811 O\n0.122178 0.743849 0.427105 O\n0.884947 0.263250 0.574840 O\n0.421499 0.085621 0.250972 F\n0.585620 0.921499 0.750972 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ca",
"Mg",
"As",
"O",
"F"
],
"chemical_system": "As-Ca-F-Mg-O",
"density": 3.717712505468483,
"density_atomic": 0.08057049850013359,
"volume": 198.58385262409007,
"volume_molar": 7.474374457283536,
"formula_full": "Ca2 Mg2 As2 O8 F2",
"formula_reduced": "CaMgAsO4F",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 1.1980081878125,
"spacegroup": 15
},
{
"id": "jvasp-2991",
"created_at": "2022-09-04T14:36:57.709489Z",
"updated_at": "2022-09-04T14:36:57.709515Z",
"structure_string": "Ca1 Mg2 As2\n1.0\n2.177059 -3.770776 0.000000\n2.177059 3.770776 0.000000\n0.000000 0.000000 7.103615\nCa Mg As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333333 0.634407 Mg\n0.333333 0.666668 0.365592 Mg\n0.333333 0.666668 0.751550 As\n0.666668 0.333333 0.248449 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"As"
],
"chemical_system": "As-Ca-Mg",
"density": 3.3961271836561773,
"density_atomic": 0.04287060968524795,
"volume": 116.63001848374766,
"volume_molar": 14.047247763010603,
"formula_full": "Ca1 Mg2 As2",
"formula_reduced": "Ca(MgAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3237344039999997,
"spacegroup": 164
},
{
"id": "jvasp-91877",
"created_at": "2022-09-04T14:35:57.488990Z",
"updated_at": "2022-09-04T14:35:57.489009Z",
"structure_string": "Ca1 Mg7\n1.0\n6.650862 -0.000000 -0.000000\n-3.325432 5.759815 -0.000000\n-0.000000 0.000000 5.215014\nCa Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Ca\n0.173510 0.836755 0.250000 Mg\n0.663246 0.326491 0.250000 Mg\n0.663246 0.836755 0.250000 Mg\n0.337817 0.162183 0.749999 Mg\n0.337817 0.675635 0.749999 Mg\n0.824365 0.162183 0.749999 Mg\n0.833333 0.666668 0.749999 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg",
"density": 1.747296945931541,
"density_atomic": 0.04004497594936256,
"volume": 199.77537282369988,
"volume_molar": 15.038442694072494,
"formula_full": "Ca1 Mg7",
"formula_reduced": "CaMg7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-94774",
"created_at": "2022-09-04T14:36:04.386294Z",
"updated_at": "2022-09-04T14:36:04.386314Z",
"structure_string": "Ca1 Mg6 Zn1\n1.0\n6.830806 0.358484 0.000000\n-3.104932 5.377674 0.000000\n0.000000 0.000000 5.027737\nCa Mg Zn\n1 6 1\ndirect\n0.125087 0.312537 0.250000 Ca\n0.638521 0.323588 0.250000 Mg\n0.638519 0.814915 0.250000 Mg\n0.341785 0.169431 0.750000 Mg\n0.341780 0.672361 0.750000 Mg\n0.801437 0.150726 0.750000 Mg\n0.883126 0.691567 0.750000 Mg\n0.229747 0.864869 0.250000 Zn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Zn"
],
"chemical_system": "Ca-Mg-Zn",
"density": 2.193147864092784,
"density_atomic": 0.04204234540321365,
"volume": 190.2843412581947,
"volume_molar": 14.323988593509048,
"formula_full": "Ca1 Mg6 Zn1",
"formula_reduced": "CaMg6Zn",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-94732",
"created_at": "2022-09-04T14:35:43.584720Z",
"updated_at": "2022-09-04T14:35:43.584740Z",
"structure_string": "Ca1 Mg6 V1\n1.0\n6.705870 -1.796059 0.000000\n-4.908367 8.501539 0.000000\n0.000000 0.000000 3.862926\nCa Mg V\n1 6 1\ndirect\n0.249970 0.374984 0.250000 Ca\n0.750081 0.375049 0.250000 Mg\n0.750080 0.875032 0.250000 Mg\n0.250056 0.099333 0.750001 Mg\n0.250056 0.650724 0.750001 Mg\n0.698535 0.099267 0.750001 Mg\n0.801336 0.650669 0.750001 Mg\n0.249884 0.874941 0.250000 V\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"V"
],
"chemical_system": "Ca-Mg-V",
"density": 2.1125534922538014,
"density_atomic": 0.042971066429199796,
"volume": 186.17178173087697,
"volume_molar": 14.01440843904172,
"formula_full": "Ca1 Mg6 V1",
"formula_reduced": "CaMg6V",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-94730",
"created_at": "2022-09-04T14:36:21.081782Z",
"updated_at": "2022-09-04T14:36:21.081796Z",
"structure_string": "Ca1 Mg6 V1\n1.0\n6.399337 0.085590 0.000000\n-3.125545 5.584783 0.000000\n0.000000 0.000000 5.058087\nCa Mg V\n1 6 1\ndirect\n0.161972 0.338028 0.250000 Ca\n0.181723 0.862629 0.250000 Mg\n0.637371 0.318277 0.250000 Mg\n0.665832 0.834168 0.250000 Mg\n0.344983 0.677961 0.750001 Mg\n0.822039 0.155017 0.750001 Mg\n0.842284 0.657716 0.750001 Mg\n0.343798 0.156202 0.750001 V\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"V"
],
"chemical_system": "Ca-Mg-V",
"density": 2.1595103248157828,
"density_atomic": 0.04392620682149018,
"volume": 182.12362457133747,
"volume_molar": 13.709676286124862,
"formula_full": "Ca1 Mg6 V1",
"formula_reduced": "CaMg6V",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0148125,
"spacegroup": 38
},
{
"id": "jvasp-94735",
"created_at": "2022-09-04T14:35:48.029015Z",
"updated_at": "2022-09-04T14:35:48.029040Z",
"structure_string": "Ca1 Mg6 Ti1\n1.0\n6.240971 -1.670677 0.000000\n-4.567333 7.910852 0.000000\n0.000000 0.000000 4.484952\nCa Mg Ti\n1 6 1\ndirect\n0.250044 0.375021 0.250000 Ca\n0.749969 0.374961 0.250000 Mg\n0.749969 0.875008 0.250000 Mg\n0.249968 0.107013 0.750000 Mg\n0.249968 0.642955 0.750000 Mg\n0.714084 0.107042 0.750000 Mg\n0.785994 0.642996 0.750000 Mg\n0.250004 0.875001 0.250000 Ti\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Ti"
],
"chemical_system": "Ca-Mg-Ti",
"density": 2.073614274849876,
"density_atomic": 0.042733729609775985,
"volume": 187.20575229572003,
"volume_molar": 14.09224239258149,
"formula_full": "Ca1 Mg6 Ti1",
"formula_reduced": "CaMg6Ti",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-94733",
"created_at": "2022-09-04T14:35:46.498717Z",
"updated_at": "2022-09-04T14:35:46.498738Z",
"structure_string": "Ca1 Mg6 Sn1\n1.0\n6.725296 -0.070992 0.000000\n-3.424129 5.788782 0.000000\n0.000000 0.000000 5.102224\nCa Mg Sn\n1 6 1\ndirect\n0.180054 0.319946 0.250000 Ca\n0.164607 0.815259 0.250000 Mg\n0.684741 0.335394 0.250000 Mg\n0.659833 0.840167 0.250000 Mg\n0.332338 0.681999 0.749999 Mg\n0.818001 0.167662 0.749999 Mg\n0.820587 0.679413 0.749999 Mg\n0.339843 0.160157 0.749999 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Sn"
],
"chemical_system": "Ca-Mg-Sn",
"density": 2.5625170518075313,
"density_atomic": 0.04052771245617286,
"volume": 197.39579451101005,
"volume_molar": 14.859315749716725,
"formula_full": "Ca1 Mg6 Sn1",
"formula_reduced": "CaMg6Sn",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-94788",
"created_at": "2022-09-04T14:36:09.104885Z",
"updated_at": "2022-09-04T14:36:09.104908Z",
"structure_string": "Ca1 Mg6 Ni1\n1.0\n6.903723 -0.425175 0.000000\n-3.820073 5.766211 0.000000\n0.000000 0.000000 4.762562\nCa Mg Ni\n1 6 1\ndirect\n0.203217 0.296784 0.250000 Ca\n0.177842 0.833782 0.250000 Mg\n0.666218 0.322158 0.250000 Mg\n0.650067 0.849934 0.250000 Mg\n0.309117 0.695477 0.750000 Mg\n0.804523 0.190884 0.750000 Mg\n0.810812 0.689189 0.750000 Mg\n0.378205 0.121795 0.750000 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Ni"
],
"chemical_system": "Ca-Mg-Ni",
"density": 2.233492827458091,
"density_atomic": 0.04399127134366751,
"volume": 181.85425780270364,
"volume_molar": 13.68939922866512,
"formula_full": "Ca1 Mg6 Ni1",
"formula_reduced": "CaMg6Ni",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-94745",
"created_at": "2022-09-04T14:36:06.342049Z",
"updated_at": "2022-09-04T14:36:06.342070Z",
"structure_string": "Ca1 Mg6 Mn1\n1.0\n6.567028 -0.065638 0.000000\n-3.340357 5.654393 0.000000\n0.000000 0.000000 5.060394\nCa Mg Mn\n1 6 1\ndirect\n0.176786 0.323214 0.250000 Ca\n0.177903 0.840501 0.250000 Mg\n0.659498 0.322096 0.250000 Mg\n0.662868 0.837130 0.250000 Mg\n0.330612 0.682386 0.749999 Mg\n0.817613 0.169388 0.749999 Mg\n0.828384 0.671615 0.749999 Mg\n0.346333 0.153667 0.749999 Mn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Mn"
],
"chemical_system": "Ca-Mg-Mn",
"density": 2.1410232287233946,
"density_atomic": 0.042827502550877056,
"volume": 186.79585601556795,
"volume_molar": 14.061386728880537,
"formula_full": "Ca1 Mg6 Mn1",
"formula_reduced": "CaMg6Mn",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
}
]
}