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_anonymous&page=452",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=450",
"results": [
{
"id": "jvasp-66225",
"created_at": "2022-09-04T14:36:06.340348Z",
"updated_at": "2022-09-04T14:36:06.340378Z",
"structure_string": "Ba4 Be1 Mo1\n1.0\n0.000000 4.801905 4.801905\n4.801905 0.000000 4.801905\n4.801905 4.801905 0.000000\nBa Be Mo\n4 1 1\ndirect\n0.123971 0.625343 0.625343 Ba\n0.625343 0.625343 0.625343 Ba\n0.625343 0.123971 0.625343 Ba\n0.625343 0.625343 0.123971 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Be",
"Mo"
],
"chemical_system": "Ba-Be-Mo",
"density": 4.906015325286713,
"density_atomic": 0.02709446396033662,
"volume": 221.44745172974652,
"volume_molar": 22.226462087663982,
"formula_full": "Ba4 Be1 Mo1",
"formula_reduced": "Ba4BeMo",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.5183076466666665,
"spacegroup": 216
},
{
"id": "jvasp-38157",
"created_at": "2022-09-04T14:36:06.338432Z",
"updated_at": "2022-09-04T14:36:06.338449Z",
"structure_string": "Rb4 N1 O1\n1.0\n4.886029 0.000000 0.000000\n0.000000 4.886029 0.000000\n0.000000 0.000000 6.906436\nRb N O\n4 1 1\ndirect\n0.000000 0.500000 0.744140 Rb\n0.500000 0.000000 0.255861 Rb\n0.000000 0.500000 0.255861 Rb\n0.500000 0.000000 0.744140 Rb\n0.000000 0.000000 0.000000 N\n0.500000 0.500000 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Rb",
"N",
"O"
],
"chemical_system": "N-O-Rb",
"density": 3.745266226474743,
"density_atomic": 0.036390261638394115,
"volume": 164.87927620914948,
"volume_molar": 16.54877016230696,
"formula_full": "Rb4 N1 O1",
"formula_reduced": "Rb4NO",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6583494583333334,
"spacegroup": 123
},
{
"id": "jvasp-63444",
"created_at": "2022-09-04T14:36:06.321281Z",
"updated_at": "2022-09-04T14:36:06.321306Z",
"structure_string": "U1 Pt4 Au1\n1.0\n0.000000 3.770216 3.770216\n3.770216 0.000000 3.770216\n3.770216 3.770216 -0.000000\nU Pt Au\n1 4 1\ndirect\n0.000000 0.000000 0.000000 U\n0.624621 0.624621 0.126141 Pt\n0.126141 0.624621 0.624621 Pt\n0.624621 0.126141 0.624621 Pt\n0.624621 0.624621 0.624621 Pt\n0.250000 0.250000 0.250000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Pt",
"Au"
],
"chemical_system": "Au-Pt-U",
"density": 18.82847527200628,
"density_atomic": 0.055978667737636455,
"volume": 107.18368697377888,
"volume_molar": 10.757920835531248,
"formula_full": "U1 Pt4 Au1",
"formula_reduced": "UPt4Au",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.029086528333334,
"spacegroup": 216
},
{
"id": "jvasp-65113",
"created_at": "2022-09-04T14:36:02.022627Z",
"updated_at": "2022-09-04T14:36:02.022652Z",
"structure_string": "Be1 Cd4 Rh1\n1.0\n0.000000 3.863659 3.863659\n3.863659 0.000000 3.863659\n3.863659 3.863659 -0.000000\nBe Cd Rh\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.125431 0.624856 0.624856 Cd\n0.624856 0.624856 0.624856 Cd\n0.624856 0.125431 0.624856 Cd\n0.624856 0.624856 0.125431 Cd\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Rh"
],
"chemical_system": "Be-Cd-Rh",
"density": 8.083886363835019,
"density_atomic": 0.052014554925792766,
"volume": 115.35232798896342,
"volume_molar": 11.577799269053756,
"formula_full": "Be1 Cd4 Rh1",
"formula_reduced": "BeCd4Rh",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-65236",
"created_at": "2022-09-04T14:36:06.303325Z",
"updated_at": "2022-09-04T14:36:06.303337Z",
"structure_string": "Na4 Be1 W1\n1.0\n-0.000000 4.007142 4.007142\n4.007142 -0.000000 4.007142\n4.007142 4.007142 0.000000\nNa Be W\n4 1 1\ndirect\n0.125082 0.624972 0.624972 Na\n0.624972 0.624972 0.624972 Na\n0.624972 0.125082 0.624972 Na\n0.624972 0.624972 0.125082 Na\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Be",
"W"
],
"chemical_system": "Be-Na-W",
"density": 3.6751245129378898,
"density_atomic": 0.046624808029296,
"volume": 128.6868569245366,
"volume_molar": 12.916172772692336,
"formula_full": "Na4 Be1 W1",
"formula_reduced": "Na4BeW",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.4899670166666676,
"spacegroup": 216
},
{
"id": "jvasp-64686",
"created_at": "2022-09-04T14:36:01.760627Z",
"updated_at": "2022-09-04T14:36:01.760656Z",
"structure_string": "Ba4 V1 Cl1\n1.0\n0.000000 5.019405 5.019405\n5.019405 0.000000 5.019405\n5.019405 5.019405 -0.000000\nBa V Cl\n4 1 1\ndirect\n0.123859 0.625380 0.625380 Ba\n0.625380 0.625380 0.625380 Ba\n0.625380 0.123859 0.625380 Ba\n0.625380 0.625380 0.123859 Ba\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"V",
"Cl"
],
"chemical_system": "Ba-Cl-V",
"density": 4.173652669251592,
"density_atomic": 0.023722723002916012,
"volume": 252.9220612348117,
"volume_molar": 25.385537567756256,
"formula_full": "Ba4 V1 Cl1",
"formula_reduced": "Ba4VCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7682486912500001,
"spacegroup": 216
},
{
"id": "jvasp-64340",
"created_at": "2022-09-04T14:36:06.266100Z",
"updated_at": "2022-09-04T14:36:06.266122Z",
"structure_string": "Ba4 Ga1 Cl1\n1.0\n0.000000 5.032492 5.032492\n5.032492 -0.000000 5.032492\n5.032492 5.032492 -0.000000\nBa Ga Cl\n4 1 1\ndirect\n0.124213 0.625262 0.625262 Ba\n0.625262 0.625262 0.625262 Ba\n0.625262 0.124213 0.625262 Ba\n0.625262 0.625262 0.124213 Ba\n0.000000 0.000000 0.000000 Ga\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ga",
"Cl"
],
"chemical_system": "Ba-Cl-Ga",
"density": 4.26352541534001,
"density_atomic": 0.023538130980028167,
"volume": 254.90554050748256,
"volume_molar": 25.58461742399903,
"formula_full": "Ba4 Ga1 Cl1",
"formula_reduced": "Ba4GaCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-69846",
"created_at": "2022-09-04T14:35:58.049767Z",
"updated_at": "2022-09-04T14:35:58.049792Z",
"structure_string": "Be1 Co1 Br4\n1.0\n-0.000000 4.400255 4.400255\n4.400255 0.000000 4.400255\n4.400255 4.400255 0.000000\nBe Co Br\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Co\n0.125461 0.624847 0.624847 Br\n0.624847 0.624847 0.624847 Br\n0.624847 0.125461 0.624847 Br\n0.624847 0.624847 0.125461 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Co",
"Br"
],
"chemical_system": "Be-Br-Co",
"density": 3.7768179961005255,
"density_atomic": 0.03521175889301041,
"volume": 170.3976225166931,
"volume_molar": 17.102641132747856,
"formula_full": "Be1 Co1 Br4",
"formula_reduced": "BeCoBr4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1084539033333338,
"spacegroup": 216
},
{
"id": "jvasp-108156",
"created_at": "2022-09-04T14:36:07.929501Z",
"updated_at": "2022-09-04T14:36:07.929524Z",
"structure_string": "Ba1 Sn1 F4\n1.0\n4.101096 -0.007918 6.074025\n1.852711 3.658759 6.074025\n-0.012912 -0.007918 7.328888\nBa Sn F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500001 0.500000 0.499999 Sn\n0.620618 0.620617 0.620616 F\n0.130542 0.130541 0.130541 F\n0.869460 0.869458 0.869457 F\n0.379383 0.379382 0.379382 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"F"
],
"chemical_system": "Ba-F-Sn",
"density": 4.990828137258838,
"density_atomic": 0.054312105697371736,
"volume": 110.4726086930257,
"volume_molar": 11.088026661230007,
"formula_full": "Ba1 Sn1 F4",
"formula_reduced": "BaSnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-66684",
"created_at": "2022-09-04T14:36:07.921783Z",
"updated_at": "2022-09-04T14:36:07.921805Z",
"structure_string": "Ba4 Nb1 Si1\n1.0\n0.000000 4.886705 4.886705\n4.886705 -0.000000 4.886705\n4.886705 4.886705 0.000000\nBa Nb Si\n4 1 1\ndirect\n0.122937 0.625687 0.625687 Ba\n0.625687 0.625687 0.625687 Ba\n0.625687 0.122937 0.625687 Ba\n0.625687 0.625687 0.122937 Ba\n0.250000 0.250000 0.250000 Nb\n0.000000 0.000000 0.000000 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Nb",
"Si"
],
"chemical_system": "Ba-Nb-Si",
"density": 4.769137856271746,
"density_atomic": 0.025708272080464882,
"volume": 233.38791425656572,
"volume_molar": 23.42491452226416,
"formula_full": "Ba4 Nb1 Si1",
"formula_reduced": "Ba4NbSi",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.5838203133333333,
"spacegroup": 216
},
{
"id": "jvasp-93817",
"created_at": "2022-09-04T14:36:01.829934Z",
"updated_at": "2022-09-04T14:36:01.829960Z",
"structure_string": "Yb1 Cu4 Au1\n1.0\n-3.534623 -3.534623 -0.000000\n-3.534623 0.000000 -3.534623\n-0.000000 -3.534623 -3.534623\nYb Cu Au\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.874358 0.375213 0.375213 Cu\n0.375213 0.874358 0.375213 Cu\n0.375213 0.375213 0.874358 Cu\n0.375213 0.375213 0.375213 Cu\n0.749999 0.749999 0.749999 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Cu",
"Au"
],
"chemical_system": "Au-Cu-Yb",
"density": 11.735646169504722,
"density_atomic": 0.0679347462233787,
"volume": 88.32004730349891,
"volume_molar": 8.864595946525482,
"formula_full": "Yb1 Cu4 Au1",
"formula_reduced": "YbCu4Au",
"formula_anonymous": "ABC4",
"energy_above_hull": 6.999999999998761e-05,
"spacegroup": 216
},
{
"id": "jvasp-63278",
"created_at": "2022-09-04T14:36:06.245645Z",
"updated_at": "2022-09-04T14:36:06.245673Z",
"structure_string": "Ga3 As3 O12\n1.0\n2.496206 -4.323653 -0.000068\n2.496129 4.323609 0.000065\n-0.000006 0.000167 11.569036\nGa As O\n3 3 12\ndirect\n0.446701 -0.000001 0.333325 Ga\n0.000004 0.446701 0.666656 Ga\n0.553302 0.553305 0.999992 Ga\n0.444141 -0.000002 0.833322 As\n-0.000006 0.444138 0.166659 As\n0.555865 0.555864 0.499992 As\n0.302510 0.390306 0.129956 O\n0.912228 0.609709 0.536688 O\n0.697452 0.087772 0.203354 O\n0.390312 0.302520 0.870024 O\n0.607321 0.931202 0.952318 O\n0.931192 0.607324 0.047665 O\n0.323874 0.392690 0.618983 O\n0.087775 0.697453 0.796627 O\n0.676114 0.068807 0.714328 O\n0.392693 0.323875 0.380998 O\n0.068807 0.676111 0.285656 O\n0.609711 0.912235 0.463295 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"As",
"O"
],
"chemical_system": "As-Ga-O",
"density": 4.162200443616509,
"density_atomic": 0.07208136307455092,
"volume": 249.7178082132452,
"volume_molar": 8.354643285215817,
"formula_full": "Ga3 As3 O12",
"formula_reduced": "GaAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8749080125,
"spacegroup": 152
}
]
}