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=nelements&page=501",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=499",
"results": [
{
"id": "jvasp-14581",
"created_at": "2022-09-04T14:36:06.471812Z",
"updated_at": "2022-09-04T14:36:06.471835Z",
"structure_string": "Tm1 Cd1\n1.0\n3.667742 0.000000 0.000000\n0.000000 3.667742 -0.000000\n0.000000 0.000000 3.667742\nTm Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tm",
"Cd"
],
"chemical_system": "Cd-Tm",
"density": 9.46874209312669,
"density_atomic": 0.04053532507246281,
"volume": 49.339680795077086,
"volume_molar": 14.856525140071147,
"formula_full": "Tm1 Cd1",
"formula_reduced": "TmCd",
"formula_anonymous": "AB",
"energy_above_hull": 0.4192364166666666,
"spacegroup": 221
},
{
"id": "jvasp-14657",
"created_at": "2022-09-04T14:36:07.305692Z",
"updated_at": "2022-09-04T14:36:07.305713Z",
"structure_string": "Zr4 Ni2\n1.0\n4.532132 -0.000000 2.601106\n2.266067 4.590013 1.300553\n-0.018707 0.000000 5.281512\nZr Ni\n4 2\ndirect\n0.162388 0.500000 0.175226 Zr\n0.337613 0.824773 0.500000 Zr\n0.662387 0.175226 0.500000 Zr\n0.837612 0.500000 0.824774 Zr\n0.250000 0.000000 0.000000 Ni\n0.750000 0.000000 0.000001 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Ni"
],
"chemical_system": "Ni-Zr",
"density": 7.274349831779393,
"density_atomic": 0.05449975654068108,
"volume": 110.09223491707397,
"volume_molar": 11.04984892089344,
"formula_full": "Zr4 Ni2",
"formula_reduced": "Zr2Ni",
"formula_anonymous": "AB2",
"energy_above_hull": 2.7375038000000007,
"spacegroup": 140
},
{
"id": "jvasp-85609",
"created_at": "2022-09-04T14:36:02.425060Z",
"updated_at": "2022-09-04T14:36:02.425088Z",
"structure_string": "Eu1 Cu1\n1.0\n3.509191 -0.000016 0.000021\n-0.000016 3.509137 0.000013\n0.000021 0.000013 3.509174\nEu Cu\n1 1\ndirect\n0.499999 0.499998 0.499999 Eu\n-0.000000 0.000001 0.000000 Cu\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Eu",
"Cu"
],
"chemical_system": "Cu-Eu",
"density": 8.28141008307622,
"density_atomic": 0.04628260148373898,
"volume": 43.21278268471326,
"volume_molar": 13.011672997931697,
"formula_full": "Eu1 Cu1",
"formula_reduced": "EuCu",
"formula_anonymous": "AB",
"energy_above_hull": 0.2280602249999999,
"spacegroup": 221
},
{
"id": "jvasp-85610",
"created_at": "2022-09-04T14:36:07.288408Z",
"updated_at": "2022-09-04T14:36:07.288424Z",
"structure_string": "Pu2 S4\n1.0\n3.936544 0.000000 -0.000000\n0.000000 3.936544 0.000000\n-0.000000 0.000000 7.712791\nPu S\n2 4\ndirect\n0.000000 0.000000 0.001576 Pu\n0.500000 0.500000 0.462424 Pu\n0.500000 0.500000 0.093829 S\n0.000000 0.500000 0.732000 S\n0.500000 0.000000 0.732000 S\n0.000000 0.000000 0.370171 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pu",
"S"
],
"chemical_system": "Pu-S",
"density": 8.561922529073811,
"density_atomic": 0.05020066465204566,
"volume": 119.5203298917976,
"volume_molar": 11.996137504834012,
"formula_full": "Pu2 S4",
"formula_reduced": "PuS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.9443566666666663,
"spacegroup": 129
},
{
"id": "jvasp-94399",
"created_at": "2022-09-04T14:36:02.430864Z",
"updated_at": "2022-09-04T14:36:02.430890Z",
"structure_string": "Mg4 Zn2\n1.0\n3.162092 0.000000 0.000000\n-1.581046 2.738452 0.000000\n0.000000 -0.000000 14.084351\nMg Zn\n4 2\ndirect\n0.666666 0.333333 0.776844 Mg\n0.333332 0.666666 0.592403 Mg\n0.666666 0.333333 0.407597 Mg\n0.333332 0.666666 0.223156 Mg\n0.333332 0.666666 0.931470 Zn\n0.666666 0.333333 0.068530 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Zn"
],
"chemical_system": "Mg-Zn",
"density": 3.104844446250746,
"density_atomic": 0.049196564519127024,
"volume": 121.95973557599278,
"volume_molar": 12.240978244850137,
"formula_full": "Mg4 Zn2",
"formula_reduced": "Mg2Zn",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2814638235294117,
"spacegroup": 164
},
{
"id": "jvasp-19924",
"created_at": "2022-09-04T14:35:54.041406Z",
"updated_at": "2022-09-04T14:35:54.041430Z",
"structure_string": "U2 N3\n1.0\n1.848166 -3.201119 -0.000000\n1.848166 3.201119 0.000000\n-0.000000 0.000000 5.785441\nU N\n2 3\ndirect\n0.333334 0.666668 0.757803 U\n0.666668 0.333334 0.242197 U\n0.000000 0.000000 0.000000 N\n0.333334 0.666668 0.356998 N\n0.666668 0.333334 0.643001 N\n",
"nsites": 5,
"nelements": 2,
"elements": [
"U",
"N"
],
"chemical_system": "N-U",
"density": 12.567095653507192,
"density_atomic": 0.07303999656649927,
"volume": 68.4556439627944,
"volume_molar": 8.24499047520784,
"formula_full": "U2 N3",
"formula_reduced": "U2N3",
"formula_anonymous": "A2B3",
"energy_above_hull": 5.51933635,
"spacegroup": 164
},
{
"id": "jvasp-93748",
"created_at": "2022-09-04T14:35:56.773668Z",
"updated_at": "2022-09-04T14:35:56.773696Z",
"structure_string": "Nd2 Ag4\n1.0\n-4.792831 0.000000 -0.000000\n-2.396417 -3.534318 4.121329\n-2.396417 3.534318 4.121329\nNd Ag\n2 4\ndirect\n0.032493 0.217507 0.717507 Nd\n0.967508 0.782493 0.282493 Nd\n0.334486 0.629195 0.701837 Ag\n0.665515 0.370806 0.298163 Ag\n0.665516 0.798164 0.870806 Ag\n0.334485 0.201837 0.129194 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nd",
"Ag"
],
"chemical_system": "Ag-Nd",
"density": 8.56230150466746,
"density_atomic": 0.042972065747683565,
"volume": 139.6255892195137,
"volume_molar": 14.014082532964169,
"formula_full": "Nd2 Ag4",
"formula_reduced": "NdAg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2193753400000001,
"spacegroup": 74
},
{
"id": "jvasp-63501",
"created_at": "2022-09-04T14:35:51.931943Z",
"updated_at": "2022-09-04T14:35:51.931973Z",
"structure_string": "Zr10 Al6\n1.0\n4.172051 -7.226206 0.000000\n4.172051 7.226206 -0.000000\n0.000000 -0.000000 5.548448\nZr Al\n10 6\ndirect\n0.333333 0.666667 0.000000 Zr\n0.666667 0.333333 0.500000 Zr\n0.666667 0.333333 0.000000 Zr\n0.333333 0.666667 0.500000 Zr\n0.237906 -0.000000 0.250000 Zr\n-0.000000 0.237906 0.250000 Zr\n0.762094 0.762094 0.250000 Zr\n0.762094 -0.000000 0.750000 Zr\n-0.000000 0.762094 0.750000 Zr\n0.237906 0.237906 0.750000 Zr\n0.606905 -0.000000 0.250000 Al\n-0.000000 0.606905 0.250000 Al\n0.393095 0.393095 0.250000 Al\n0.393095 -0.000000 0.750000 Al\n-0.000000 0.393095 0.750000 Al\n0.606905 0.606905 0.750000 Al\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 5.331435637577951,
"density_atomic": 0.047825389986856245,
"volume": 334.5503299481143,
"volume_molar": 12.591932364074925,
"formula_full": "Zr10 Al6",
"formula_reduced": "Zr5Al3",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.8328776125,
"spacegroup": 193
},
{
"id": "jvasp-22565",
"created_at": "2022-09-04T14:36:01.582289Z",
"updated_at": "2022-09-04T14:36:01.582309Z",
"structure_string": "Sn4 O4\n1.0\n3.852557 0.258746 0.000005\n-0.258749 3.852385 0.000066\n0.000068 0.000108 9.854297\nSn O\n4 4\ndirect\n0.499829 0.500155 0.739404 Sn\n0.000171 0.999849 0.003599 Sn\n0.500167 0.499816 0.239398 Sn\n0.999835 0.000187 0.503603 Sn\n0.000176 0.499825 0.121504 O\n0.499825 0.000177 0.621496 O\n0.999826 0.500177 0.621504 O\n0.500175 0.999826 0.121497 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.090429030149873,
"density_atomic": 0.054454137455927726,
"volume": 146.9126199359006,
"volume_molar": 11.059105958429695,
"formula_full": "Sn4 O4",
"formula_reduced": "SnO",
"formula_anonymous": "AB",
"energy_above_hull": 0.2262225999999998,
"spacegroup": 129
},
{
"id": "jvasp-90587",
"created_at": "2022-09-04T14:36:07.282468Z",
"updated_at": "2022-09-04T14:36:07.282499Z",
"structure_string": "Li6 Mg2\n1.0\n3.362428 0.000000 0.000000\n0.000000 9.698100 0.000000\n0.000000 0.000000 4.880480\nLi Mg\n6 2\ndirect\n0.500000 0.000000 0.916823 Li\n0.000000 0.241741 0.916523 Li\n0.500000 0.258259 0.416524 Li\n0.000000 0.500000 0.416823 Li\n0.500000 0.741740 0.416524 Li\n0.000000 0.758259 0.916523 Li\n0.000000 0.000000 0.416795 Mg\n0.500000 0.500000 0.916795 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Mg"
],
"chemical_system": "Li-Mg",
"density": 0.9417225956602369,
"density_atomic": 0.05026755920845907,
"volume": 159.14836777381768,
"volume_molar": 11.980173405727225,
"formula_full": "Li6 Mg2",
"formula_reduced": "Li3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5173414285714286,
"spacegroup": 71
},
{
"id": "jvasp-2157",
"created_at": "2022-09-04T14:35:52.226503Z",
"updated_at": "2022-09-04T14:35:52.226537Z",
"structure_string": "Sb2 F6\n1.0\n4.367152 -0.020172 0.000000\n-1.730556 4.009688 0.000000\n0.000000 0.000000 7.150453\nSb F\n2 6\ndirect\n0.205662 0.790590 0.250000 Sb\n0.790589 0.205663 0.750000 Sb\n0.315356 0.380898 0.250000 F\n0.380898 0.315356 0.750000 F\n0.976715 0.588033 0.932154 F\n0.588031 0.976716 0.067845 F\n0.976715 0.588033 0.567845 F\n0.588031 0.976716 0.432155 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sb",
"F"
],
"chemical_system": "F-Sb",
"density": 4.750748115523657,
"density_atomic": 0.06401978200444032,
"volume": 124.96137521126097,
"volume_molar": 9.406687388567354,
"formula_full": "Sb2 F6",
"formula_reduced": "SbF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 40
},
{
"id": "jvasp-92178",
"created_at": "2022-09-04T14:35:56.796960Z",
"updated_at": "2022-09-04T14:35:56.796986Z",
"structure_string": "Zr4 Sn4\n1.0\n5.812225 -0.000000 0.000000\n-0.000000 5.254411 0.000000\n0.000000 0.000000 5.958457\nZr Sn\n4 4\ndirect\n0.103541 0.250000 0.875761 Zr\n0.603540 0.250000 0.624240 Zr\n0.396459 0.750000 0.375761 Zr\n0.896459 0.750000 0.124240 Zr\n0.114554 0.250000 0.375072 Sn\n0.614554 0.250000 0.124928 Sn\n0.385445 0.750000 0.875073 Sn\n0.885445 0.750000 0.624928 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.662872535328522,
"density_atomic": 0.043963242780715665,
"volume": 181.9701981471934,
"volume_molar": 13.698126842093624,
"formula_full": "Zr4 Sn4",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy_above_hull": 1.3797631,
"spacegroup": 62
}
]
}