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{
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"results": [
{
"id": "jvasp-15117",
"created_at": "2022-09-04T14:36:02.717072Z",
"updated_at": "2022-09-04T14:36:02.717100Z",
"structure_string": "Li2 Mg1 Tl1\n1.0\n4.116818 -0.000000 2.376846\n1.372273 3.881373 2.376846\n0.000000 0.000000 4.753693\nLi Mg Tl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.749999 0.750001 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500001 Tl\n",
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"density_atomic": 0.052660116088920905,
"volume": 75.958814698503,
"volume_molar": 11.435866851928552,
"formula_full": "Li2 Mg1 Tl1",
"formula_reduced": "Li2MgTl",
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},
{
"id": "jvasp-40998",
"created_at": "2022-09-04T14:37:34.017969Z",
"updated_at": "2022-09-04T14:37:34.017994Z",
"structure_string": "Li1 Mg1 Tl2\n1.0\n0.000000 3.589020 3.589020\n3.589020 -0.000000 3.589020\n3.589020 3.589020 -0.000000\nLi Mg Tl\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.749999 0.749999 Mg\n0.000000 0.000000 0.000000 Tl\n0.500001 0.500001 0.500001 Tl\n",
"nsites": 4,
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"elements": [
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"density": 7.902355793079429,
"density_atomic": 0.0432615783620483,
"volume": 92.46079665713363,
"volume_molar": 13.920298306274905,
"formula_full": "Li1 Mg1 Tl2",
"formula_reduced": "LiMgTl2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-18736",
"created_at": "2022-09-04T14:37:05.067970Z",
"updated_at": "2022-09-04T14:37:05.068004Z",
"structure_string": "Li1 Mg2 Tl1\n1.0\n4.250229 -0.000000 2.453871\n1.416743 4.007154 2.453871\n0.000000 0.000000 4.907742\nLi Mg Tl\n1 2 1\ndirect\n0.500000 0.499999 0.500000 Li\n0.250000 0.250000 0.250000 Mg\n0.750000 0.749999 0.750000 Mg\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Li-Mg-Tl",
"density": 5.163956811756276,
"density_atomic": 0.04785528467724952,
"volume": 83.58533497349785,
"volume_molar": 12.584066317053875,
"formula_full": "Li1 Mg2 Tl1",
"formula_reduced": "LiMg2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-103703",
"created_at": "2022-09-04T14:36:56.683220Z",
"updated_at": "2022-09-04T14:36:56.683241Z",
"structure_string": "Li2 Mg1 Tl1\n1.0\n4.164269 -0.000000 2.404242\n1.388090 3.926110 2.404242\n-0.000000 -0.000000 4.808484\nLi Mg Tl\n2 1 1\ndirect\n0.500000 0.500000 0.499999 Li\n0.750000 0.750000 0.749999 Li\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Mg",
"Tl"
],
"chemical_system": "Li-Mg-Tl",
"density": 5.123624671883406,
"density_atomic": 0.050880407017930195,
"volume": 78.61572330957189,
"volume_molar": 11.835873792986375,
"formula_full": "Li2 Mg1 Tl1",
"formula_reduced": "Li2MgTl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1861583333333333,
"spacegroup": 216
},
{
"id": "jvasp-77419",
"created_at": "2022-09-04T14:38:11.080482Z",
"updated_at": "2022-09-04T14:38:11.080510Z",
"structure_string": "Sr2 Li1 Mg1\n1.0\n-11.753085 0.000001 -6.785648\n-7.724919 0.293945 -0.191343\n-6.631235 3.387350 -2.085659\nSr Li Mg\n2 1 1\ndirect\n0.760949 0.000000 -0.000000 Sr\n0.239052 0.000000 -0.000000 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 -0.000000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Li",
"Mg"
],
"chemical_system": "Li-Mg-Sr",
"density": 2.0917262979752613,
"density_atomic": 0.02440198406120292,
"volume": 163.92109715208198,
"volume_molar": 24.67889801458682,
"formula_full": "Sr2 Li1 Mg1",
"formula_reduced": "Sr2LiMg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0126749754166667,
"spacegroup": 71
},
{
"id": "jvasp-81664",
"created_at": "2022-09-04T14:37:07.915629Z",
"updated_at": "2022-09-04T14:37:07.915644Z",
"structure_string": "Sr2 Li1 Mg1\n1.0\n-11.753085 0.000001 -6.785648\n-7.724919 0.293945 -0.191343\n-6.631235 3.387350 -2.085659\nSr Li Mg\n2 1 1\ndirect\n0.760949 0.000000 -0.000000 Sr\n0.239052 0.000000 -0.000000 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 -0.000000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Li",
"Mg"
],
"chemical_system": "Li-Mg-Sr",
"density": 2.0917262979752613,
"density_atomic": 0.02440198406120292,
"volume": 163.92109715208198,
"volume_molar": 24.67889801458682,
"formula_full": "Sr2 Li1 Mg1",
"formula_reduced": "Sr2LiMg",
"formula_anonymous": "ABC2",
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"spacegroup": 71
},
{
"id": "jvasp-93169",
"created_at": "2022-09-04T14:36:03.898880Z",
"updated_at": "2022-09-04T14:36:03.898904Z",
"structure_string": "Sr1 Li1 Mg6\n1.0\n7.104236 -0.344156 0.000000\n-3.850166 5.980370 0.000000\n0.000000 0.000000 5.119346\nSr Li Mg\n1 1 6\ndirect\n0.305212 0.194788 0.750001 Sr\n0.136025 0.363974 0.250000 Li\n0.184117 0.818170 0.250000 Mg\n0.681830 0.315882 0.250000 Mg\n0.693506 0.806493 0.250000 Mg\n0.328306 0.688011 0.750001 Mg\n0.811989 0.171693 0.750001 Mg\n0.859012 0.640987 0.750001 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
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"Li",
"Mg"
],
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"density": 1.8943836374563574,
"density_atomic": 0.03796563073374773,
"volume": 210.71689961122607,
"volume_molar": 15.862085374619909,
"formula_full": "Sr1 Li1 Mg6",
"formula_reduced": "SrLiMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-93200",
"created_at": "2022-09-04T14:36:03.716094Z",
"updated_at": "2022-09-04T14:36:03.716105Z",
"structure_string": "Sr1 Li1 Mg6\n1.0\n7.202574 0.493734 0.000000\n-3.173701 5.497011 0.000000\n0.000000 0.000000 5.132612\nSr Li Mg\n1 1 6\ndirect\n0.108271 0.804134 0.250000 Sr\n0.237133 0.368566 0.250000 Li\n0.632833 0.308193 0.250000 Mg\n0.632833 0.824637 0.250000 Mg\n0.357363 0.179521 0.750000 Mg\n0.357363 0.677843 0.750000 Mg\n0.903322 0.201661 0.750000 Mg\n0.770880 0.635441 0.750000 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
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],
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"density": 1.8895474362335503,
"density_atomic": 0.03786870768914957,
"volume": 211.25621887256057,
"volume_molar": 15.902683580949102,
"formula_full": "Sr1 Li1 Mg6",
"formula_reduced": "SrLiMg6",
"formula_anonymous": "ABC6",
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"spacegroup": 38
},
{
"id": "jvasp-39859",
"created_at": "2022-09-04T14:37:51.820918Z",
"updated_at": "2022-09-04T14:37:51.820938Z",
"structure_string": "Li2 Mg1 Sn1\n1.0\n-0.000000 3.327497 3.327497\n3.327497 0.000000 3.327497\n3.327497 3.327497 -0.000000\nLi Mg Sn\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.250001 0.250001 0.250001 Mg\n0.750001 0.750001 0.750001 Sn\n",
"nsites": 4,
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"elements": [
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"Mg",
"Sn"
],
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"density": 3.535743271685726,
"density_atomic": 0.05428464197702361,
"volume": 73.6856660433172,
"volume_molar": 11.09363632268021,
"formula_full": "Li2 Mg1 Sn1",
"formula_reduced": "Li2MgSn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1481526875,
"spacegroup": 225
},
{
"id": "jvasp-93170",
"created_at": "2022-09-04T14:36:07.307451Z",
"updated_at": "2022-09-04T14:36:07.307478Z",
"structure_string": "Li1 Mg6 Si1\n1.0\n6.187113 0.027893 0.000000\n-3.069400 5.372144 0.000000\n0.000000 0.000000 4.961162\nLi Mg Si\n1 6 1\ndirect\n0.169226 0.330773 0.250000 Li\n0.169273 0.843336 0.250000 Mg\n0.656663 0.330726 0.250000 Mg\n0.663989 0.836010 0.250000 Mg\n0.333828 0.657444 0.750000 Mg\n0.842555 0.166171 0.750000 Mg\n0.834132 0.665866 0.750000 Mg\n0.330329 0.169670 0.750000 Si\n",
"nsites": 8,
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"elements": [
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"Mg",
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],
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"density": 1.816548082578697,
"density_atomic": 0.04838978197356458,
"volume": 165.32415881456984,
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"formula_full": "Li1 Mg6 Si1",
"formula_reduced": "LiMg6Si",
"formula_anonymous": "ABC6",
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"spacegroup": 38
},
{
"id": "jvasp-93166",
"created_at": "2022-09-04T14:35:59.694137Z",
"updated_at": "2022-09-04T14:35:59.694172Z",
"structure_string": "Li1 Mg6 Si1\n1.0\n6.211454 0.006425 0.000000\n-3.100162 5.369638 0.000000\n0.000000 0.000000 4.968942\nLi Mg Si\n1 6 1\ndirect\n0.166104 0.333052 0.250000 Li\n0.669486 0.332618 0.250000 Mg\n0.669486 0.836867 0.250000 Mg\n0.326812 0.162498 0.750000 Mg\n0.326812 0.664316 0.750000 Mg\n0.836294 0.168148 0.750000 Mg\n0.836674 0.668338 0.750000 Mg\n0.168335 0.834167 0.250000 Si\n",
"nsites": 8,
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"elements": [
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],
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"density": 1.811013665707993,
"density_atomic": 0.04824235442771949,
"volume": 165.82938571097793,
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"formula_full": "Li1 Mg6 Si1",
"formula_reduced": "LiMg6Si",
"formula_anonymous": "ABC6",
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"spacegroup": 38
},
{
"id": "jvasp-79622",
"created_at": "2022-09-04T14:36:50.221661Z",
"updated_at": "2022-09-04T14:36:50.221693Z",
"structure_string": "Li1 Mg2 Si1\n1.0\n-3.307946 -3.307946 -0.000000\n-3.307946 -0.000000 -3.307946\n0.000000 -3.307946 -3.307946\nLi Mg Si\n1 2 1\ndirect\n0.500001 0.500001 0.500001 Li\n0.250000 0.250000 0.250000 Mg\n0.750001 0.750001 0.750001 Mg\n0.000000 0.000000 0.000000 Si\n",
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"formula_full": "Li1 Mg2 Si1",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
}
]
}