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=334",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=332",
"results": [
{
"id": "jvasp-87115",
"created_at": "2022-09-04T14:36:10.251329Z",
"updated_at": "2022-09-04T14:36:10.251356Z",
"structure_string": "Pr2 Fe17\n1.0\n6.287299 0.030509 0.788304\n0.699403 6.248352 0.788304\n0.033948 0.030509 6.336435\nPr Fe\n2 17\ndirect\n0.344903 0.344903 0.344903 Pr\n0.655097 0.655097 0.655095 Pr\n0.849037 0.334440 0.334439 Fe\n0.150963 0.665560 0.665559 Fe\n0.665559 0.665560 0.150963 Fe\n0.665560 0.150964 0.665559 Fe\n0.285321 1.000000 0.714677 Fe\n-0.000000 0.714679 0.285321 Fe\n0.714679 0.285321 -0.000001 Fe\n0.334441 0.334440 0.849035 Fe\n0.285321 0.714679 0.999999 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.500000 0.000000 -0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.909004 0.909004 0.909002 Fe\n0.090996 0.090996 0.090996 Fe\n0.334440 0.849036 0.334439 Fe\n1.000000 0.285321 0.714677 Fe\n0.714679 0.000000 0.285320 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Pr",
"Fe"
],
"chemical_system": "Fe-Pr",
"density": 8.227303140779242,
"density_atomic": 0.07646106541142754,
"volume": 248.49248304039907,
"volume_molar": 7.876087950901032,
"formula_full": "Pr2 Fe17",
"formula_reduced": "Pr2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.102594378947368,
"spacegroup": 166
},
{
"id": "jvasp-86324",
"created_at": "2022-09-04T14:38:07.235508Z",
"updated_at": "2022-09-04T14:38:07.235526Z",
"structure_string": "Pr2 Fe17\n1.0\n6.287186 0.030224 0.787971\n0.699108 6.248270 0.787971\n0.033631 0.030224 6.336283\nPr Fe\n2 17\ndirect\n0.344923 0.344922 0.344923 Pr\n0.655078 0.655076 0.655076 Pr\n0.849062 0.334426 0.334427 Fe\n0.150939 0.665572 0.665573 Fe\n0.665574 0.665572 0.150938 Fe\n0.665573 0.150938 0.665573 Fe\n0.285332 -0.000001 0.714668 Fe\n0.000000 0.714668 0.285332 Fe\n0.714669 0.285332 -0.000000 Fe\n0.334427 0.334426 0.849061 Fe\n0.285332 0.714668 -0.000000 Fe\n0.000000 0.500000 -0.000000 Fe\n0.500000 -0.000000 -0.000000 Fe\n-0.000000 -0.000000 0.500000 Fe\n0.909006 0.909004 0.909004 Fe\n0.090995 0.090995 0.090995 Fe\n0.334427 0.849061 0.334427 Fe\n0.000000 0.285332 0.714668 Fe\n0.714668 -0.000001 0.285332 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Pr",
"Fe"
],
"chemical_system": "Fe-Pr",
"density": 8.227616486062317,
"density_atomic": 0.076463977509569,
"volume": 248.48301930961236,
"volume_molar": 7.875787993433071,
"formula_full": "Pr2 Fe17",
"formula_reduced": "Pr2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.102592273684211,
"spacegroup": 166
},
{
"id": "jvasp-114479",
"created_at": "2022-09-04T14:38:41.234426Z",
"updated_at": "2022-09-04T14:38:41.234445Z",
"structure_string": "B1 C1 Cl1\n1.0\n3.967140 0.000000 0.000000\n-1.983570 3.435644 -0.000000\n0.000000 0.000000 2.699464\nB C Cl\n1 1 1\ndirect\n0.000000 0.000000 0.000000 B\n0.333332 0.666666 0.000000 C\n0.666666 0.333333 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"B",
"C",
"Cl"
],
"chemical_system": "B-C-Cl",
"density": 2.630061601972743,
"density_atomic": 0.08153762016805459,
"volume": 36.79283248415634,
"volume_molar": 7.385720539289666,
"formula_full": "B1 C1 Cl1",
"formula_reduced": "BCCl",
"formula_anonymous": "ABC",
"energy_above_hull": 4.102362216944444,
"spacegroup": 187
},
{
"id": "jvasp-14930",
"created_at": "2022-09-04T14:36:02.867697Z",
"updated_at": "2022-09-04T14:36:02.867736Z",
"structure_string": "B4 W4\n1.0\n3.098634 -0.000000 -0.560714\n-0.101465 3.096972 -0.560714\n-0.006605 -0.006826 8.805725\nB W\n4 4\ndirect\n0.780762 0.030763 0.061526 B\n0.530762 0.280762 0.561526 B\n0.219237 0.969235 0.938475 B\n0.469237 0.719236 0.438475 B\n0.927885 0.177885 0.355774 W\n0.677885 0.427885 0.855774 W\n0.072114 0.822112 0.644228 W\n0.322114 0.572113 0.144227 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"B",
"W"
],
"chemical_system": "B-W",
"density": 15.304352538398494,
"density_atomic": 0.09469765401539089,
"volume": 84.47938951792604,
"volume_molar": 6.35933468744774,
"formula_full": "B4 W4",
"formula_reduced": "BW",
"formula_anonymous": "AB",
"energy_above_hull": 4.1023512916666665,
"spacegroup": 141
},
{
"id": "jvasp-103278",
"created_at": "2022-09-04T14:36:40.394713Z",
"updated_at": "2022-09-04T14:36:40.394733Z",
"structure_string": "Mg1 Nb1 Os2\n1.0\n3.866381 0.000000 2.232256\n1.288794 3.645259 2.232256\n-0.000000 -0.000000 4.464512\nMg Nb Os\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250001 Os\n0.749999 0.750000 0.750002 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Nb",
"Os"
],
"chemical_system": "Mg-Nb-Os",
"density": 13.133628576579058,
"density_atomic": 0.06357010925968877,
"volume": 62.922654162189545,
"volume_molar": 9.473227008937632,
"formula_full": "Mg1 Nb1 Os2",
"formula_reduced": "MgNbOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.1020521125,
"spacegroup": 225
},
{
"id": "jvasp-67954",
"created_at": "2022-09-04T14:36:13.690572Z",
"updated_at": "2022-09-04T14:36:13.690597Z",
"structure_string": "Be1 V2 Os1\n1.0\n-1.792875 1.792875 3.944475\n1.792875 -1.792875 3.944475\n1.792875 1.792875 -3.944475\nBe V Os\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Be\n0.000000 0.000000 0.000000 V\n0.250000 0.750001 0.500001 V\n0.750001 0.250000 0.500001 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Os"
],
"chemical_system": "Be-Os-V",
"density": 9.859319735823478,
"density_atomic": 0.07886980540537251,
"volume": 50.71649383995469,
"volume_molar": 7.635546618947001,
"formula_full": "Be1 V2 Os1",
"formula_reduced": "BeV2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.101544875,
"spacegroup": 119
},
{
"id": "jvasp-75850",
"created_at": "2022-09-04T14:36:01.597698Z",
"updated_at": "2022-09-04T14:36:01.597719Z",
"structure_string": "Zr1 Cr2 As1\n1.0\n0.000000 3.102124 3.102124\n3.102124 -0.000000 3.102124\n3.102124 3.102124 0.000000\nZr Cr As\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Zr\n0.000000 0.000000 0.000000 Cr\n0.749999 0.749999 0.749999 Cr\n0.499999 0.499999 0.499999 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cr",
"As"
],
"chemical_system": "As-Cr-Zr",
"density": 7.513235455836871,
"density_atomic": 0.06699656470691384,
"volume": 59.704553770757926,
"volume_molar": 8.988730670512325,
"formula_full": "Zr1 Cr2 As1",
"formula_reduced": "ZrCr2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.101397762500001,
"spacegroup": 216
},
{
"id": "jvasp-120413",
"created_at": "2022-09-04T14:38:53.764188Z",
"updated_at": "2022-09-04T14:38:53.764220Z",
"structure_string": "Ce2 B8 Rh8\n1.0\n5.358782 0.000000 0.000000\n0.000000 5.358782 0.000000\n0.000000 -0.000000 7.530125\nCe B Rh\n2 8 8\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Ce\n0.500000 0.833437 0.850537 B\n0.333437 0.000000 0.350537 B\n0.666563 0.000000 0.350537 B\n0.500000 0.166563 0.850537 B\n-0.000000 0.333437 0.649462 B\n0.166563 0.500000 0.149462 B\n0.833437 0.500000 0.149462 B\n-0.000000 0.666563 0.649462 B\n0.500000 0.750043 0.145517 Rh\n0.249957 0.500000 0.854483 Rh\n0.750043 0.500000 0.854483 Rh\n-0.000000 0.749956 0.354483 Rh\n-0.000000 0.250043 0.354483 Rh\n0.250043 0.000000 0.645516 Rh\n0.749956 0.000000 0.645516 Rh\n0.500000 0.249957 0.145517 Rh\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ce",
"B",
"Rh"
],
"chemical_system": "B-Ce-Rh",
"density": 9.137945319523817,
"density_atomic": 0.08324116307944697,
"volume": 216.23916983020112,
"volume_molar": 7.234570658572314,
"formula_full": "Ce2 B8 Rh8",
"formula_reduced": "Ce(BRh)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 4.10134087037037,
"spacegroup": 137
},
{
"id": "jvasp-57801",
"created_at": "2022-09-04T14:37:50.783178Z",
"updated_at": "2022-09-04T14:37:50.783198Z",
"structure_string": "Nd3 Co11 B4\n1.0\n2.558677 -4.431760 -0.000000\n2.558677 4.431760 0.000000\n0.000000 0.000000 9.763669\nNd Co B\n3 11 4\ndirect\n0.000000 0.000000 0.341020 Nd\n0.000000 0.000000 0.658980 Nd\n0.000000 0.000000 0.000000 Nd\n0.500000 0.000000 0.500000 Co\n0.333334 0.666668 0.000000 Co\n0.666668 0.333334 0.000000 Co\n0.500001 0.500001 0.202794 Co\n0.000000 0.500000 0.202794 Co\n0.500000 0.000000 0.202794 Co\n0.500001 0.500001 0.797206 Co\n0.000000 0.500000 0.797206 Co\n0.500000 0.000000 0.797206 Co\n0.500001 0.500001 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.666668 0.333334 0.349137 B\n0.333334 0.666668 0.349137 B\n0.333334 0.666668 0.650863 B\n0.666668 0.333334 0.650863 B\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Nd",
"Co",
"B"
],
"chemical_system": "B-Co-Nd",
"density": 8.430852923140042,
"density_atomic": 0.08129011968007316,
"volume": 221.42912411546595,
"volume_molar": 7.408207521038037,
"formula_full": "Nd3 Co11 B4",
"formula_reduced": "Nd3Co11B4",
"formula_anonymous": "A3B4C11",
"energy_above_hull": 4.101274707407407,
"spacegroup": 191
},
{
"id": "jvasp-18789",
"created_at": "2022-09-04T14:36:01.706355Z",
"updated_at": "2022-09-04T14:36:01.706366Z",
"structure_string": "Rh6 W2\n1.0\n2.754439 -4.770828 -0.000000\n2.754439 4.770828 -0.000000\n-0.000000 -0.000000 4.376768\nRh W\n6 2\ndirect\n0.166953 0.333907 0.750000 Rh\n0.333907 0.166953 0.250000 Rh\n0.833048 0.166953 0.250000 Rh\n0.166953 0.833048 0.750000 Rh\n0.666094 0.833048 0.750000 Rh\n0.833048 0.666094 0.250000 Rh\n0.666667 0.333333 0.750000 W\n0.333333 0.666667 0.250000 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Rh",
"W"
],
"chemical_system": "Rh-W",
"density": 14.22082222028501,
"density_atomic": 0.06954718345049743,
"volume": 115.02982008889363,
"volume_molar": 8.659072102159914,
"formula_full": "Rh6 W2",
"formula_reduced": "Rh3W",
"formula_anonymous": "AB3",
"energy_above_hull": 4.10107725,
"spacegroup": 194
},
{
"id": "jvasp-62955",
"created_at": "2022-09-04T14:36:11.487915Z",
"updated_at": "2022-09-04T14:36:11.487937Z",
"structure_string": "Dy4 Fe4 B16\n1.0\n3.396135 0.000000 0.000000\n0.000000 5.885452 -0.000000\n0.000000 0.000000 11.384185\nDy Fe B\n4 4 16\ndirect\n0.000000 0.126385 0.849637 Dy\n0.000000 0.873615 0.150362 Dy\n0.000000 0.373615 0.349637 Dy\n0.000000 0.626385 0.650362 Dy\n0.000000 0.132978 0.588414 Fe\n0.000000 0.867021 0.411585 Fe\n0.000000 0.367022 0.088415 Fe\n0.000000 0.632978 0.911585 Fe\n0.499999 0.524571 0.190193 B\n0.499999 0.475428 0.809806 B\n0.499999 0.888799 0.545883 B\n0.499999 0.111201 0.454116 B\n0.499999 0.611201 0.045884 B\n0.499999 0.388799 0.954116 B\n0.499999 0.860718 0.968247 B\n0.499999 0.782004 0.816374 B\n0.499999 0.639281 0.468247 B\n0.499999 0.360718 0.531752 B\n0.499999 0.024571 0.309807 B\n0.499999 0.217995 0.183626 B\n0.499999 0.717995 0.316374 B\n0.499999 0.282004 0.683626 B\n0.499999 0.139281 0.031752 B\n0.499999 0.975428 0.690193 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Dy",
"Fe",
"B"
],
"chemical_system": "B-Dy-Fe",
"density": 7.6359285163026405,
"density_atomic": 0.10547378454223326,
"volume": 227.5446937280424,
"volume_molar": 5.709609061755669,
"formula_full": "Dy4 Fe4 B16",
"formula_reduced": "DyFeB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.100163722222223,
"spacegroup": 55
},
{
"id": "jvasp-75574",
"created_at": "2022-09-04T14:36:15.286636Z",
"updated_at": "2022-09-04T14:36:15.286656Z",
"structure_string": "Tc2 As1 Rh1\n1.0\n0.000000 3.099297 3.099297\n3.099297 0.000000 3.099297\n3.099297 3.099297 -0.000000\nTc As Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Tc\n0.250000 0.250000 0.250000 Tc\n0.500000 0.500000 0.500000 As\n0.750001 0.750001 0.750001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tc",
"As",
"Rh"
],
"chemical_system": "As-Rh-Tc",
"density": 10.42558169617718,
"density_atomic": 0.06718006319066269,
"volume": 59.54147421159254,
"volume_molar": 8.964178469003008,
"formula_full": "Tc2 As1 Rh1",
"formula_reduced": "Tc2AsRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.0996394375000005,
"spacegroup": 216
}
]
}