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=density_atomic&page=105",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=103",
"results": [
{
"id": "jvasp-107140",
"created_at": "2022-09-04T14:36:54.475061Z",
"updated_at": "2022-09-04T14:36:54.475086Z",
"structure_string": "Rb3 Bi1 Br6\n1.0\n7.360010 -0.000000 4.249304\n2.453337 6.939084 4.249304\n-0.000000 -0.000000 8.498607\nRb Bi Br\n3 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Bi\n0.762851 0.237149 0.237149 Br\n0.237149 0.237149 0.762851 Br\n0.237150 0.762850 0.762851 Br\n0.237150 0.762850 0.237149 Br\n0.762851 0.237149 0.762851 Br\n0.762851 0.762850 0.237149 Br\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Bi",
"Br"
],
"chemical_system": "Bi-Br-Rb",
"density": 3.6146335191707815,
"density_atomic": 0.023039428607366602,
"volume": 434.03854194555026,
"volume_molar": 26.138411948612678,
"formula_full": "Rb3 Bi1 Br6",
"formula_reduced": "Rb3BiBr6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110356",
"created_at": "2022-09-04T14:38:38.145062Z",
"updated_at": "2022-09-04T14:38:38.145083Z",
"structure_string": "K2 Ag1 Bi1 I6\n1.0\n7.359959 -0.000000 4.249274\n2.453320 6.939036 4.249274\n0.000000 0.000000 8.498549\nK Ag Bi I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 Bi\n0.745109 0.254891 0.254891 I\n0.254891 0.254891 0.745109 I\n0.254891 0.745109 0.745108 I\n0.254891 0.745109 0.254891 I\n0.745109 0.254891 0.745108 I\n0.745109 0.745109 0.254890 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Ag",
"Bi",
"I"
],
"chemical_system": "Ag-Bi-I-K",
"density": 4.424507227192349,
"density_atomic": 0.023039904869464604,
"volume": 434.02956985526725,
"volume_molar": 26.137871636706723,
"formula_full": "K2 Ag1 Bi1 I6",
"formula_reduced": "K2AgBiI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-85206",
"created_at": "2022-09-04T14:37:04.460424Z",
"updated_at": "2022-09-04T14:37:04.460449Z",
"structure_string": "Ba4 Na2 O2\n1.0\n-6.639459 0.000000 0.000000\n0.000000 -0.000000 -6.903074\n3.319729 -7.575370 -0.000000\nBa Na O\n4 2 2\ndirect\n0.411826 0.197005 0.823652 Ba\n0.588174 0.802995 0.176348 Ba\n0.911826 0.802995 0.823652 Ba\n0.088174 0.197005 0.176348 Ba\n0.250000 0.694391 0.500000 Na\n0.750000 0.305608 0.500000 Na\n0.250000 0.000000 0.000000 O\n0.750000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Na",
"O"
],
"chemical_system": "Ba-Na-O",
"density": 3.0001008545305705,
"density_atomic": 0.023041508843183386,
"volume": 347.1994848274324,
"volume_molar": 26.13605211787853,
"formula_full": "Ba4 Na2 O2",
"formula_reduced": "Ba2NaO",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 67
},
{
"id": "jvasp-20267",
"created_at": "2022-09-04T14:37:46.540674Z",
"updated_at": "2022-09-04T14:37:46.540684Z",
"structure_string": "Ba8 Sn4\n1.0\n5.664589 0.000000 0.000000\n0.000000 8.625424 0.000000\n0.000000 0.000000 10.658381\nBa Sn\n8 4\ndirect\n0.750000 0.842166 0.079491 Ba\n0.250000 0.157834 0.920509 Ba\n0.750000 0.342166 0.420509 Ba\n0.250000 0.657833 0.579491 Ba\n0.750000 0.979144 0.681735 Ba\n0.250000 0.020855 0.318265 Ba\n0.750000 0.479145 0.818265 Ba\n0.250000 0.520855 0.181735 Ba\n0.750000 0.753703 0.397453 Sn\n0.250000 0.246297 0.602547 Sn\n0.750000 0.253703 0.102547 Sn\n0.250000 0.746296 0.897453 Sn\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ba",
"Sn"
],
"chemical_system": "Ba-Sn",
"density": 5.01722528231383,
"density_atomic": 0.02304311290700172,
"volume": 520.7629736672324,
"volume_molar": 26.13423275016872,
"formula_full": "Ba8 Sn4",
"formula_reduced": "Ba2Sn",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-121196",
"created_at": "2022-09-04T14:38:53.827980Z",
"updated_at": "2022-09-04T14:38:53.828008Z",
"structure_string": "Li2 Te1\n1.0\n4.454852 0.000000 0.000000\n0.000000 4.975472 0.000000\n0.000000 0.000000 5.872770\nLi Te\n2 1\ndirect\n-0.033326 0.000000 0.777329 Li\n-0.033326 0.000000 0.222671 Li\n0.466652 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Te"
],
"chemical_system": "Li-Te",
"density": 1.804844242504524,
"density_atomic": 0.023046803300760355,
"volume": 130.16989648629598,
"volume_molar": 26.130047978503463,
"formula_full": "Li2 Te1",
"formula_reduced": "Li2Te",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5130925888888892,
"spacegroup": 47
},
{
"id": "jvasp-103588",
"created_at": "2022-09-04T14:36:45.299989Z",
"updated_at": "2022-09-04T14:36:45.300009Z",
"structure_string": "Ba2 Yb6\n1.0\n7.871505 -0.000000 0.000000\n-3.935752 6.816923 0.000000\n-0.000000 -0.000000 6.468826\nYb Ba\n6 2\ndirect\n0.164133 0.328265 0.250000 Yb\n0.671734 0.835867 0.250000 Yb\n0.164133 0.835867 0.250000 Yb\n0.835867 0.671734 0.750001 Yb\n0.328265 0.164133 0.750001 Yb\n0.835867 0.164133 0.750001 Yb\n0.333333 0.666666 0.750001 Ba\n0.666666 0.333333 0.250000 Ba\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Yb",
"Ba"
],
"chemical_system": "Ba-Yb",
"density": 6.280686661913316,
"density_atomic": 0.023047209697396685,
"volume": 347.11360312322955,
"volume_molar": 26.129587221485803,
"formula_full": "Ba2 Yb6",
"formula_reduced": "BaYb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-114583",
"created_at": "2022-09-04T14:38:41.761204Z",
"updated_at": "2022-09-04T14:38:41.761231Z",
"structure_string": "Ba1 Tl1 Te1\n1.0\n-0.000000 4.022118 4.022118\n4.022118 -0.000000 4.022118\n4.022118 4.022118 0.000000\nBa Tl Te\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Te"
],
"chemical_system": "Ba-Te-Tl",
"density": 5.988454643696468,
"density_atomic": 0.0230529673938619,
"volume": 130.13509058268926,
"volume_molar": 26.123061110143507,
"formula_full": "Ba1 Tl1 Te1",
"formula_reduced": "BaTlTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-104506",
"created_at": "2022-09-04T14:36:43.067185Z",
"updated_at": "2022-09-04T14:36:43.067202Z",
"structure_string": "K2 In1 Hg1 I6\n1.0\n7.358201 -0.000000 4.248259\n2.452734 6.937379 4.248259\n-0.000000 -0.000000 8.496519\nK In Hg I\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Hg\n0.752935 0.247065 0.247065 I\n0.247065 0.247065 0.752935 I\n0.247064 0.752935 0.752936 I\n0.247064 0.752935 0.247065 I\n0.752935 0.247065 0.752935 I\n0.752935 0.752935 0.247065 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"In",
"Hg",
"I"
],
"chemical_system": "Hg-I-In-K",
"density": 4.422163488708982,
"density_atomic": 0.02305642127202152,
"volume": 433.7186539931411,
"volume_molar": 26.11914784584432,
"formula_full": "K2 In1 Hg1 I6",
"formula_reduced": "K2InHgI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-64209",
"created_at": "2022-09-04T14:36:04.979338Z",
"updated_at": "2022-09-04T14:36:04.979358Z",
"structure_string": "Ba4 Mg1 Se1\n1.0\n-0.000000 5.067230 5.067230\n5.067230 -0.000000 5.067230\n5.067230 5.067230 0.000000\nBa Mg Se\n4 1 1\ndirect\n0.120989 0.626337 0.626337 Ba\n0.626337 0.626337 0.626337 Ba\n0.626337 0.120989 0.626337 Ba\n0.626337 0.626337 0.120989 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Se"
],
"chemical_system": "Ba-Mg-Se",
"density": 4.164245749652435,
"density_atomic": 0.023057350585119204,
"volume": 260.2207039291102,
"volume_molar": 26.11809512878978,
"formula_full": "Ba4 Mg1 Se1",
"formula_reduced": "Ba4MgSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-102424",
"created_at": "2022-09-04T14:36:49.908619Z",
"updated_at": "2022-09-04T14:36:49.908641Z",
"structure_string": "Rb2 Li1 Pr1 I6\n1.0\n7.358026 -0.000000 4.248158\n2.452675 6.937213 4.248158\n-0.000000 -0.000000 8.496316\nRb Li Pr I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.742080 0.257920 0.257921 I\n0.257921 0.257920 0.742080 I\n0.257921 0.742079 0.742080 I\n0.257921 0.742079 0.257921 I\n0.742080 0.257920 0.742080 I\n0.742080 0.742079 0.257921 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Pr",
"I"
],
"chemical_system": "I-Li-Pr-Rb",
"density": 4.136001781358911,
"density_atomic": 0.023058072270599517,
"volume": 433.6875989737713,
"volume_molar": 26.117277668864826,
"formula_full": "Rb2 Li1 Pr1 I6",
"formula_reduced": "Rb2LiPrI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-66475",
"created_at": "2022-09-04T14:36:18.576465Z",
"updated_at": "2022-09-04T14:36:18.576494Z",
"structure_string": "Ba1 Na1 Hg1\n1.0\n-0.000000 4.021650 4.021650\n4.021650 -0.000000 4.021650\n4.021650 4.021650 0.000000\nBa Na Hg\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Hg"
],
"chemical_system": "Ba-Hg-Na",
"density": 4.6068207527021166,
"density_atomic": 0.023061016362033136,
"volume": 130.08966963568426,
"volume_molar": 26.113943398932953,
"formula_full": "Ba1 Na1 Hg1",
"formula_reduced": "BaNaHg",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1404984411111111,
"spacegroup": 216
},
{
"id": "jvasp-3510",
"created_at": "2022-09-04T14:36:16.045305Z",
"updated_at": "2022-09-04T14:36:16.045336Z",
"structure_string": "Bi2 I6\n1.0\n6.725523 -0.009121 4.718348\n2.448622 6.263944 4.718348\n-0.013378 -0.009121 8.215552\nBi I\n2 6\ndirect\n0.666561 0.666562 0.666563 Bi\n0.333438 0.333438 0.333438 Bi\n0.914704 0.245117 0.578667 I\n0.245117 0.578666 0.914706 I\n0.421333 0.085295 0.754883 I\n0.754882 0.421333 0.085295 I\n0.085295 0.754882 0.421334 I\n0.578666 0.914705 0.245118 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Bi",
"I"
],
"chemical_system": "Bi-I",
"density": 5.645962422037894,
"density_atomic": 0.02306334566607214,
"volume": 346.8707496227914,
"volume_molar": 26.111305996939585,
"formula_full": "Bi2 I6",
"formula_reduced": "BiI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 148
}
]
}