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=-energy_above_hull&page=4186",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4184",
"results": [
{
"id": "jvasp-94156",
"created_at": "2022-09-04T14:36:15.476220Z",
"updated_at": "2022-09-04T14:36:15.476247Z",
"structure_string": "Hf1 Mg6 Cu1\n1.0\n6.426673 0.291335 0.000000\n-2.961034 5.128660 0.000000\n0.000000 0.000000 4.869021\nHf Mg Cu\n1 6 1\ndirect\n0.133363 0.816682 0.250000 Hf\n0.637193 0.319213 0.250000 Mg\n0.637193 0.817982 0.250000 Mg\n0.335975 0.165545 0.750000 Mg\n0.335975 0.670431 0.750000 Mg\n0.886966 0.193485 0.750000 Mg\n0.830742 0.665373 0.750000 Mg\n0.202591 0.351294 0.250000 Cu\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Hf",
"Mg",
"Cu"
],
"chemical_system": "Cu-Hf-Mg",
"density": 3.9109175364664264,
"density_atomic": 0.04857779937090099,
"volume": 164.68428178309267,
"volume_molar": 12.3968990732161,
"formula_full": "Hf1 Mg6 Cu1",
"formula_reduced": "HfMg6Cu",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0067834687499999,
"spacegroup": 38
},
{
"id": "jvasp-110442",
"created_at": "2022-09-04T14:38:38.481197Z",
"updated_at": "2022-09-04T14:38:38.481217Z",
"structure_string": "K2 Rb6\n1.0\n9.761519 0.000000 -0.000000\n-4.880759 8.453723 0.000000\n0.000000 -0.000000 7.932717\nK Rb\n2 6\ndirect\n0.666667 0.333333 0.250000 K\n0.333333 0.666667 0.750000 K\n0.831538 0.168462 0.750000 Rb\n0.336924 0.168462 0.750000 Rb\n0.831538 0.663075 0.750000 Rb\n0.168462 0.831538 0.250000 Rb\n0.663075 0.831538 0.250000 Rb\n0.168462 0.336924 0.250000 Rb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Rb"
],
"chemical_system": "K-Rb",
"density": 1.4991728150830113,
"density_atomic": 0.012220883628236737,
"volume": 654.6171490837003,
"volume_molar": 49.27745769614935,
"formula_full": "K2 Rb6",
"formula_reduced": "KRb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0067724999999999,
"spacegroup": 194
},
{
"id": "jvasp-109441",
"created_at": "2022-09-04T14:38:19.764578Z",
"updated_at": "2022-09-04T14:38:19.764606Z",
"structure_string": "K3 Y1 F6\n1.0\n5.678911 -0.000000 3.278721\n1.892970 5.354129 3.278721\n-0.000000 -0.000000 6.557441\nK Y F\n3 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Y\n0.767199 0.232801 0.232801 F\n0.232801 0.232801 0.767199 F\n0.232801 0.767199 0.767199 F\n0.232801 0.767199 0.232801 F\n0.767199 0.232801 0.767199 F\n0.767199 0.767199 0.232801 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Y",
"F"
],
"chemical_system": "F-K-Y",
"density": 2.6666754490698557,
"density_atomic": 0.05015470901714226,
"volume": 199.38307281539852,
"volume_molar": 12.007129296556593,
"formula_full": "K3 Y1 F6",
"formula_reduced": "K3YF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.006756,
"spacegroup": 225
},
{
"id": "jvasp-102929",
"created_at": "2022-09-04T14:36:43.593462Z",
"updated_at": "2022-09-04T14:36:43.593483Z",
"structure_string": "Ga1 Ag3\n1.0\n4.110417 -0.000000 0.000000\n-0.000000 4.110417 0.000000\n-0.000000 -0.000000 4.110417\nGa Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 0.500000 Ag\n0.000000 0.500000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ga",
"Ag"
],
"chemical_system": "Ag-Ga",
"density": 9.404720003987933,
"density_atomic": 0.05759732873256337,
"volume": 69.44766516122388,
"volume_molar": 10.455590376355957,
"formula_full": "Ga1 Ag3",
"formula_reduced": "GaAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0066824999999999,
"spacegroup": 221
},
{
"id": "jvasp-101409",
"created_at": "2022-09-04T14:36:35.392208Z",
"updated_at": "2022-09-04T14:36:35.392236Z",
"structure_string": "Na3 Zn1\n1.0\n4.316237 -0.292549 -3.717902\n-1.096584 4.184853 -3.717902\n0.241992 0.292549 5.691585\nNa Zn\n3 1\ndirect\n0.750000 0.250000 0.500001 Na\n0.250000 0.750000 0.500001 Na\n0.500001 0.500000 0.000001 Na\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 2.0121619701508986,
"density_atomic": 0.03606987709588705,
"volume": 110.8958588732233,
"volume_molar": 16.695761795891144,
"formula_full": "Na3 Zn1",
"formula_reduced": "Na3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0066474999999999,
"spacegroup": 139
},
{
"id": "jvasp-69243",
"created_at": "2022-09-04T14:35:45.094577Z",
"updated_at": "2022-09-04T14:35:45.094606Z",
"structure_string": "Ba2 Cd1 Sn1\n1.0\n0.000000 4.224966 4.224966\n4.224966 0.000000 4.224966\n4.224966 4.224966 -0.000000\nBa Cd Sn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Sn"
],
"chemical_system": "Ba-Cd-Sn",
"density": 5.568097168131772,
"density_atomic": 0.026519195233797494,
"volume": 150.83413975180454,
"volume_molar": 22.708610524971963,
"formula_full": "Ba2 Cd1 Sn1",
"formula_reduced": "Ba2CdSn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0066325,
"spacegroup": 225
},
{
"id": "jvasp-25372",
"created_at": "2022-09-04T14:37:49.844831Z",
"updated_at": "2022-09-04T14:37:49.844842Z",
"structure_string": "Yb3\n1.0\n-1.883264 -3.261929 -0.000020\n-1.883264 3.261929 0.000020\n0.000000 2.174562 -9.240661\nYb\n3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.777596 0.222400 0.332794 Yb\n0.222401 0.777594 0.667206 Yb\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Yb"
],
"chemical_system": "Yb",
"density": 7.592721839425559,
"density_atomic": 0.026424202314117098,
"volume": 113.53228242569327,
"volume_molar": 22.790246185719973,
"formula_full": "Yb3",
"formula_reduced": "Yb",
"formula_anonymous": "A",
"energy_above_hull": 0.0066307000000001,
"spacegroup": 166
},
{
"id": "jvasp-25146",
"created_at": "2022-09-04T14:37:50.405962Z",
"updated_at": "2022-09-04T14:37:50.405982Z",
"structure_string": "Nd1\n1.0\n3.162202 0.000000 1.825699\n1.054067 2.981353 1.825699\n-0.000000 -0.000000 3.651397\nNd\n1\ndirect\n0.000000 0.000000 0.000000 Nd\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Nd"
],
"chemical_system": "Nd",
"density": 6.9579093909624765,
"density_atomic": 0.029049451451159978,
"volume": 34.42405794413267,
"volume_molar": 20.730652246996318,
"formula_full": "Nd1",
"formula_reduced": "Nd",
"formula_anonymous": "A",
"energy_above_hull": 0.0066014999999999,
"spacegroup": 225
},
{
"id": "jvasp-14844",
"created_at": "2022-09-04T14:35:50.087714Z",
"updated_at": "2022-09-04T14:35:50.087735Z",
"structure_string": "Nd1\n1.0\n3.162202 0.000000 1.825699\n1.054067 2.981353 1.825699\n-0.000000 -0.000000 3.651397\nNd\n1\ndirect\n0.000000 0.000000 0.000000 Nd\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Nd"
],
"chemical_system": "Nd",
"density": 6.9579093909624765,
"density_atomic": 0.029049451451159978,
"volume": 34.42405794413267,
"volume_molar": 20.730652246996318,
"formula_full": "Nd1",
"formula_reduced": "Nd",
"formula_anonymous": "A",
"energy_above_hull": 0.0066014999999999,
"spacegroup": 225
},
{
"id": "jvasp-107147",
"created_at": "2022-09-04T14:36:57.635000Z",
"updated_at": "2022-09-04T14:36:57.635021Z",
"structure_string": "Ca1 Cl2\n1.0\n4.089780 -0.000000 2.361235\n1.363260 3.855881 2.361235\n-0.000000 -0.000000 4.722471\nCa Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.250000 0.250000 Cl\n0.750000 0.750000 0.750001 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"Cl"
],
"chemical_system": "Ca-Cl",
"density": 2.4746660599227104,
"density_atomic": 0.040283610300581814,
"volume": 74.47197452301516,
"volume_molar": 14.949357108424374,
"formula_full": "Ca1 Cl2",
"formula_reduced": "CaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0065833333333332,
"spacegroup": 225
},
{
"id": "jvasp-37747",
"created_at": "2022-09-04T14:38:15.538397Z",
"updated_at": "2022-09-04T14:38:15.538426Z",
"structure_string": "Na3 Tl1\n1.0\n4.922280 0.000000 0.000000\n0.000000 4.922280 0.000000\n-0.000000 -0.000000 4.922280\nNa Tl\n3 1\ndirect\n0.000000 0.500000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Tl"
],
"chemical_system": "Na-Tl",
"density": 3.8060402368672146,
"density_atomic": 0.033539844720961845,
"volume": 119.26113651623635,
"volume_molar": 17.955183782458786,
"formula_full": "Na3 Tl1",
"formula_reduced": "Na3Tl",
"formula_anonymous": "AB3",
"energy_above_hull": 0.00653,
"spacegroup": 221
},
{
"id": "jvasp-52327",
"created_at": "2022-09-04T14:37:05.720104Z",
"updated_at": "2022-09-04T14:37:05.720126Z",
"structure_string": "Ba2 Ca2 I8\n1.0\n-5.362621 4.957156 5.145889\n5.362621 -4.957156 5.145889\n5.362621 4.957156 -5.145889\nBa Ca I\n2 2 8\ndirect\n0.349702 0.250000 0.099702 Ba\n0.650299 0.750000 0.900299 Ba\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.697609 0.071514 0.269123 I\n0.761972 0.561270 0.200701 I\n0.860570 0.061270 0.799300 I\n0.697609 0.428486 0.626095 I\n0.302391 0.571514 0.373905 I\n0.238029 0.438730 0.799299 I\n0.139431 0.938730 0.200701 I\n0.302391 0.928486 0.730877 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"I"
],
"chemical_system": "Ba-Ca-I",
"density": 4.157708854426731,
"density_atomic": 0.02193063212934624,
"volume": 547.1798500482952,
"volume_molar": 27.45995065022105,
"formula_full": "Ba2 Ca2 I8",
"formula_reduced": "BaCaI4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0065266666666666,
"spacegroup": 74
}
]
}