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=4101",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=4099",
"results": [
{
"id": "jvasp-28896",
"created_at": "2022-09-04T14:37:01.664106Z",
"updated_at": "2022-09-04T14:37:01.664117Z",
"structure_string": "Te2 W4 Se6\n1.0\n3.384865 -0.000002 -0.000000\n-1.692433 2.931376 -0.000011\n-0.000010 -0.000153 36.411944\nTe W Se\n2 4 6\ndirect\n0.666707 0.333405 0.416505 Te\n0.666643 0.333285 0.520505 Te\n0.333322 0.666645 0.097401 W\n0.333342 0.666677 0.468507 W\n0.666662 0.333325 0.277731 W\n0.666676 0.333359 0.659278 W\n0.333337 0.666668 0.323393 Se\n0.333358 0.666721 0.704864 Se\n0.666628 0.333261 0.051809 Se\n0.666678 0.333356 0.143045 Se\n0.333322 0.666646 0.232094 Se\n0.333329 0.666668 0.613613 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Te",
"W",
"Se"
],
"chemical_system": "Se-Te-W",
"density": 6.730208109268319,
"density_atomic": 0.033214265126841405,
"volume": 361.2905465219055,
"volume_molar": 18.131187720102027,
"formula_full": "Te2 W4 Se6",
"formula_reduced": "TeW2Se3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.825122977777778,
"spacegroup": 156
},
{
"id": "jvasp-107512",
"created_at": "2022-09-04T14:36:50.367160Z",
"updated_at": "2022-09-04T14:36:50.367185Z",
"structure_string": "Tm1 U1 Te4\n1.0\n5.652903 0.000704 -5.587446\n-0.497362 4.000220 -6.850236\n0.042266 -0.000704 7.948149\nTm U Te\n1 1 4\ndirect\n0.138537 0.138537 -0.000000 Tm\n0.864167 0.864167 -0.000002 U\n0.704067 0.204067 0.499999 Te\n0.294725 0.794725 0.500000 Te\n0.750509 0.499252 0.251256 Te\n0.247996 0.499253 0.748744 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"U",
"Te"
],
"chemical_system": "Te-Tm-U",
"density": 8.43249837941151,
"density_atomic": 0.03321369113912301,
"volume": 180.64839511115014,
"volume_molar": 18.131501057124034,
"formula_full": "Tm1 U1 Te4",
"formula_reduced": "TmUTe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8666568861111117,
"spacegroup": 44
},
{
"id": "jvasp-28974",
"created_at": "2022-09-04T14:37:29.073752Z",
"updated_at": "2022-09-04T14:37:29.073785Z",
"structure_string": "Te2 Mo1 W3 Se6\n1.0\n3.385769 -0.000000 -0.000000\n-1.692885 2.932181 0.000014\n-0.000001 0.000224 36.395644\nTe Mo W Se\n2 1 3 6\ndirect\n0.333297 0.666594 0.334792 Te\n0.333338 0.666674 0.230751 Te\n0.333271 0.666539 0.092582 Mo\n0.333358 0.666712 0.473666 W\n0.666660 0.333318 0.282771 W\n0.666718 0.333434 0.653893 W\n0.333403 0.666803 0.699493 Se\n0.666605 0.333207 0.047199 Se\n0.666695 0.333389 0.427996 Se\n0.666619 0.333237 0.138055 Se\n0.666683 0.333364 0.519313 Se\n0.333362 0.666722 0.608238 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 6.325612209246131,
"density_atomic": 0.03321113654008441,
"volume": 361.32458115417154,
"volume_molar": 18.132895731320534,
"formula_full": "Te2 Mo1 W3 Se6",
"formula_reduced": "Te2Mo(WSe2)3",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 4.026902636111111,
"spacegroup": 156
},
{
"id": "jvasp-97524",
"created_at": "2022-09-04T14:36:19.944902Z",
"updated_at": "2022-09-04T14:36:19.944923Z",
"structure_string": "Al6 Bi10 Cl24\n1.0\n10.304841 0.010848 6.344566\n3.549737 9.674152 6.344566\n0.015518 0.010848 12.101364\nAl Bi Cl\n6 10 24\ndirect\n0.750000 0.224874 0.275126 Al\n0.250000 0.775126 0.724874 Al\n0.775126 0.724874 0.250000 Al\n0.224874 0.275126 0.750000 Al\n0.724874 0.250000 0.775126 Al\n0.275126 0.750000 0.224874 Al\n0.087967 0.250000 0.412033 Bi\n0.912033 0.750000 0.587967 Bi\n0.829412 0.829412 0.829412 Bi\n0.412033 0.087967 0.250000 Bi\n0.750000 0.587967 0.912033 Bi\n0.250000 0.412033 0.087967 Bi\n0.170588 0.170588 0.170588 Bi\n0.670588 0.670588 0.670588 Bi\n0.587968 0.912033 0.750000 Bi\n0.329412 0.329412 0.329412 Bi\n0.696695 0.267771 0.108991 Cl\n0.573245 0.194253 0.462416 Cl\n0.232229 0.803305 0.391010 Cl\n0.305748 0.926755 0.037585 Cl\n0.391010 0.232229 0.803305 Cl\n0.803305 0.391010 0.232229 Cl\n0.608991 0.767771 0.196695 Cl\n0.891010 0.303305 0.732229 Cl\n0.426756 0.805748 0.537584 Cl\n0.805748 0.537585 0.426756 Cl\n0.926755 0.037585 0.305748 Cl\n0.108991 0.696695 0.267771 Cl\n0.767771 0.196695 0.608990 Cl\n0.462416 0.573245 0.194253 Cl\n0.732229 0.891010 0.303305 Cl\n0.303305 0.732229 0.891009 Cl\n0.037585 0.305748 0.926755 Cl\n0.962416 0.694252 0.073245 Cl\n0.196695 0.608990 0.767771 Cl\n0.194253 0.462416 0.573245 Cl\n0.267771 0.108991 0.696695 Cl\n0.694252 0.073245 0.962415 Cl\n0.073245 0.962416 0.694252 Cl\n0.537585 0.426756 0.805748 Cl\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Al",
"Bi",
"Cl"
],
"chemical_system": "Al-Bi-Cl",
"density": 4.277200869432301,
"density_atomic": 0.03320852749985039,
"volume": 1204.5098958446804,
"volume_molar": 18.13432034897401,
"formula_full": "Al6 Bi10 Cl24",
"formula_reduced": "Al3Bi5Cl12",
"formula_anonymous": "A3B5C12",
"energy_above_hull": 0.6220549354999999,
"spacegroup": 167
},
{
"id": "jvasp-109602",
"created_at": "2022-09-04T14:38:27.615533Z",
"updated_at": "2022-09-04T14:38:27.615548Z",
"structure_string": "Tb1 Ho3\n1.0\n4.938684 -0.000000 0.000000\n0.000000 4.938684 0.000000\n-0.000000 -0.000000 4.938684\nTb Ho\n1 3\ndirect\n0.000000 0.000000 0.000000 Tb\n-0.000000 0.500000 0.500000 Ho\n0.500000 0.000000 0.500000 Ho\n0.500000 0.500000 -0.000000 Ho\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tb",
"Ho"
],
"chemical_system": "Ho-Tb",
"density": 9.011657998764013,
"density_atomic": 0.033206742520033604,
"volume": 120.45746425102682,
"volume_molar": 18.13529513280879,
"formula_full": "Tb1 Ho3",
"formula_reduced": "TbHo3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.408481275,
"spacegroup": 221
},
{
"id": "jvasp-109978",
"created_at": "2022-09-04T14:38:20.249678Z",
"updated_at": "2022-09-04T14:38:20.249719Z",
"structure_string": "Yb1 La1 Mg2\n1.0\n4.800999 -0.000000 2.771858\n1.600333 4.526425 2.771858\n-0.000000 -0.000000 5.543716\nYb La Mg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.499999 0.500001 La\n0.250000 0.250000 0.250001 Mg\n0.750000 0.749999 0.750002 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"La",
"Mg"
],
"chemical_system": "La-Mg-Yb",
"density": 4.969735419088456,
"density_atomic": 0.03320259847290727,
"volume": 120.4724986589206,
"volume_molar": 18.137558615823277,
"formula_full": "Yb1 La1 Mg2",
"formula_reduced": "LaYbMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107985",
"created_at": "2022-09-04T14:38:30.965991Z",
"updated_at": "2022-09-04T14:38:30.966021Z",
"structure_string": "Sr1 La1 Hg2\n1.0\n4.801059 -0.000000 2.771893\n1.600353 4.526482 2.771893\n-0.000000 -0.000000 5.543785\nSr La Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 La\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"La",
"Hg"
],
"chemical_system": "Hg-La-Sr",
"density": 8.651686835469398,
"density_atomic": 0.03320135218999504,
"volume": 120.47702084872822,
"volume_molar": 18.1382394474124,
"formula_full": "Sr1 La1 Hg2",
"formula_reduced": "SrLaHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109231",
"created_at": "2022-09-04T14:38:20.135762Z",
"updated_at": "2022-09-04T14:38:20.135788Z",
"structure_string": "Na2 Ga1 Ag1 Br6\n1.0\n6.516091 -0.000000 3.762067\n2.172030 6.143430 3.762067\n-0.000000 -0.000000 7.524134\nNa Ga Ag Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ag\n0.758977 0.241023 0.241023 Br\n0.241023 0.241023 0.758977 Br\n0.241023 0.758977 0.758977 Br\n0.241023 0.758977 0.241023 Br\n0.758977 0.241023 0.758977 Br\n0.758977 0.758977 0.241024 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Ga",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ga-Na",
"density": 3.875668254679964,
"density_atomic": 0.03320056110892213,
"volume": 301.19972873930305,
"volume_molar": 18.138671633419005,
"formula_full": "Na2 Ga1 Ag1 Br6",
"formula_reduced": "Na2GaAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-87133",
"created_at": "2022-09-04T14:36:04.081016Z",
"updated_at": "2022-09-04T14:36:04.081043Z",
"structure_string": "U2 Te4\n1.0\n4.034525 0.000005 -1.100391\n-0.656319 5.685435 -2.406347\n-0.011473 -0.045723 7.904192\nU Te\n2 4\ndirect\n0.134112 0.134111 0.268223 U\n0.865889 0.865889 0.731777 U\n0.500001 0.750229 0.000000 Te\n0.500001 0.249771 1.000000 Te\n0.202498 0.702497 0.404994 Te\n0.797504 0.297503 0.595006 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"U",
"Te"
],
"chemical_system": "Te-U",
"density": 9.06213001204399,
"density_atomic": 0.03319356677823821,
"volume": 180.75791734239345,
"volume_molar": 18.142493695338974,
"formula_full": "U2 Te4",
"formula_reduced": "UTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.074680511111111,
"spacegroup": 71
},
{
"id": "jvasp-106516",
"created_at": "2022-09-04T14:36:55.465257Z",
"updated_at": "2022-09-04T14:36:55.465279Z",
"structure_string": "Dy3 Er1\n1.0\n4.939353 -0.000000 0.000000\n0.000000 4.939353 0.000000\n-0.000000 -0.000000 4.939353\nDy Er\n3 1\ndirect\n-0.000000 0.500000 0.500000 Dy\n0.500000 0.000000 0.500000 Dy\n0.500000 0.500000 -0.000000 Dy\n0.000000 0.000000 0.000000 Er\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Dy",
"Er"
],
"chemical_system": "Dy-Er",
"density": 9.022364727968364,
"density_atomic": 0.03319325150087972,
"volume": 120.5064228159145,
"volume_molar": 18.14266601703782,
"formula_full": "Dy3 Er1",
"formula_reduced": "Dy3Er",
"formula_anonymous": "AB3",
"energy_above_hull": 1.398539875,
"spacegroup": 221
},
{
"id": "jvasp-107662",
"created_at": "2022-09-04T14:36:58.269974Z",
"updated_at": "2022-09-04T14:36:58.269994Z",
"structure_string": "K1 Hg3\n1.0\n4.801522 -0.000000 2.772160\n1.600507 4.526918 2.772160\n-0.000000 -0.000000 5.544320\nK Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Hg"
],
"chemical_system": "Hg-K",
"density": 8.830555985465491,
"density_atomic": 0.033191750100238185,
"volume": 120.51187382166077,
"volume_molar": 18.14348668513501,
"formula_full": "K1 Hg3",
"formula_reduced": "KHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.247103947368421,
"spacegroup": 225
},
{
"id": "jvasp-28973",
"created_at": "2022-09-04T14:37:19.989695Z",
"updated_at": "2022-09-04T14:37:19.989721Z",
"structure_string": "Te4 Mo2 W2 S4\n1.0\n3.362636 -0.000001 0.000009\n-1.681320 2.912154 0.000036\n0.000083 0.000483 36.920247\nTe Mo W S\n4 2 2 4\ndirect\n0.333245 0.666516 0.327351 Te\n0.666755 0.333482 0.424107 Te\n0.666722 0.333470 0.526764 Te\n0.333277 0.666528 0.224695 Te\n0.333406 0.666813 0.475422 Mo\n0.666594 0.333185 0.276036 Mo\n0.333346 0.666665 0.093695 W\n0.666654 0.333334 0.657763 W\n0.333314 0.666647 0.698917 S\n0.666685 0.333351 0.052541 S\n0.666677 0.333307 0.134896 S\n0.333322 0.666692 0.616562 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 5.503347580875094,
"density_atomic": 0.033191167359605186,
"volume": 361.54196898191714,
"volume_molar": 18.143805232138824,
"formula_full": "Te4 Mo2 W2 S4",
"formula_reduced": "Te2MoWS2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.542148572222222,
"spacegroup": 164
}
]
}