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=4556",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4554",
"results": [
{
"id": "jvasp-39411",
"created_at": "2022-09-04T14:37:46.760417Z",
"updated_at": "2022-09-04T14:37:46.760433Z",
"structure_string": "Np1 Pa3\n1.0\n-2.124247 2.124247 5.242255\n2.124247 -2.124247 5.242255\n2.124247 2.124247 -5.242255\nNp Pa\n1 3\ndirect\n0.000000 0.000000 0.000000 Np\n0.750002 0.250000 0.500001 Pa\n0.250000 0.750002 0.500001 Pa\n0.500001 0.500001 0.000000 Pa\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Np",
"Pa"
],
"chemical_system": "Np-Pa",
"density": 16.3227807854321,
"density_atomic": 0.04227385274180317,
"volume": 94.62113672086805,
"volume_molar": 14.245545105106807,
"formula_full": "Np1 Pa3",
"formula_reduced": "NpPa3",
"formula_anonymous": "AB3",
"energy_above_hull": 5.413509825000001,
"spacegroup": 139
},
{
"id": "jvasp-27047",
"created_at": "2022-09-04T14:38:33.559461Z",
"updated_at": "2022-09-04T14:38:33.559487Z",
"structure_string": "Fe12 Mo12 N4\n1.0\n6.733550 0.000000 3.887617\n2.244516 6.348452 3.887617\n-0.000000 -0.000000 7.775234\nFe Mo N\n12 12 4\ndirect\n0.298003 0.605991 0.298003 Fe\n0.701998 0.701997 0.701997 Fe\n0.298003 0.298003 0.605991 Fe\n0.605991 0.298003 0.298003 Fe\n0.701998 0.394009 0.701997 Fe\n0.394009 0.701997 0.701997 Fe\n0.298003 0.298003 0.298003 Fe\n0.701998 0.701997 0.394009 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.671622 0.078378 0.671622 Mo\n0.328378 0.328378 0.921622 Mo\n0.328378 0.921622 0.328378 Mo\n0.921623 0.921622 0.328378 Mo\n0.921623 0.328378 0.921622 Mo\n0.078378 0.671622 0.078378 Mo\n0.671622 0.078378 0.078378 Mo\n0.328378 0.921622 0.921622 Mo\n0.671623 0.671622 0.078378 Mo\n0.921623 0.328378 0.328378 Mo\n0.078378 0.671622 0.671622 Mo\n0.078378 0.078378 0.671622 Mo\n0.000000 0.500000 0.000000 N\n0.500000 -0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Fe",
"Mo",
"N"
],
"chemical_system": "Fe-Mo-N",
"density": 9.379751640223684,
"density_atomic": 0.08424276902770685,
"volume": 332.37274039260274,
"volume_molar": 7.148555097968542,
"formula_full": "Fe12 Mo12 N4",
"formula_reduced": "Fe3Mo3N",
"formula_anonymous": "AB3C3",
"energy_above_hull": 5.415956778571428,
"spacegroup": 227
},
{
"id": "jvasp-14020",
"created_at": "2022-09-04T14:37:28.485408Z",
"updated_at": "2022-09-04T14:37:28.485437Z",
"structure_string": "U2 Fe2 C4\n1.0\n4.873650 0.000000 -2.702786\n-1.498888 4.637434 -2.702786\n-0.435863 -0.598942 4.959517\nU Fe C\n2 2 4\ndirect\n0.750000 0.250000 0.500000 U\n0.499999 0.499999 -0.000001 U\n0.000000 0.000000 0.000000 Fe\n0.250000 0.750000 0.499999 Fe\n0.951044 0.874999 0.249998 C\n0.625001 0.048956 0.750001 C\n0.298956 0.375000 0.249999 C\n0.125000 0.701044 0.750000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"U",
"Fe",
"C"
],
"chemical_system": "C-Fe-U",
"density": 10.961807644505312,
"density_atomic": 0.08306325581471197,
"volume": 96.31214092842072,
"volume_molar": 7.250065869598833,
"formula_full": "U2 Fe2 C4",
"formula_reduced": "UFeC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.416015375000001,
"spacegroup": 122
},
{
"id": "jvasp-75770",
"created_at": "2022-09-04T14:35:51.341150Z",
"updated_at": "2022-09-04T14:35:51.341181Z",
"structure_string": "Si1 As1 W2\n1.0\n-0.000000 3.159566 3.159566\n3.159566 0.000000 3.159566\n3.159566 3.159566 0.000000\nSi As W\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Si\n0.500001 0.500001 0.500001 As\n0.000000 0.000000 0.000000 W\n0.250000 0.250000 0.250000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"As",
"W"
],
"chemical_system": "As-Si-W",
"density": 12.389937123685462,
"density_atomic": 0.06340853224332545,
"volume": 63.08299306866626,
"volume_molar": 9.497366595540313,
"formula_full": "Si1 As1 W2",
"formula_reduced": "SiAsW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.4180325875,
"spacegroup": 216
},
{
"id": "jvasp-75807",
"created_at": "2022-09-04T14:35:50.153776Z",
"updated_at": "2022-09-04T14:35:50.153799Z",
"structure_string": "As1 P1 W2\n1.0\n-0.000000 3.165109 3.165109\n3.165109 -0.000000 3.165109\n3.165109 3.165109 -0.000000\nAs P W\n1 1 2\ndirect\n0.500000 0.500000 0.500000 As\n0.750000 0.750000 0.750000 P\n0.000000 0.000000 0.000000 W\n0.250000 0.250000 0.250000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"As",
"P",
"W"
],
"chemical_system": "As-P-W",
"density": 12.400585445899786,
"density_atomic": 0.06307597656435769,
"volume": 63.41558574077279,
"volume_molar": 9.547439592719567,
"formula_full": "As1 P1 W2",
"formula_reduced": "AsPW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.4218118125000005,
"spacegroup": 216
},
{
"id": "jvasp-14769",
"created_at": "2022-09-04T14:38:12.418127Z",
"updated_at": "2022-09-04T14:38:12.418158Z",
"structure_string": "Ta6 Sb2\n1.0\n5.299668 -0.000000 0.000000\n0.000000 5.299668 0.000000\n-0.000000 -0.000000 5.299668\nTa Sb\n6 2\ndirect\n0.250000 0.000000 0.500000 Ta\n0.750000 0.000000 0.500000 Ta\n0.000000 0.500000 0.250000 Ta\n0.000000 0.500000 0.750000 Ta\n0.500000 0.750000 0.000000 Ta\n0.500000 0.250000 0.000000 Ta\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ta",
"Sb"
],
"chemical_system": "Sb-Ta",
"density": 14.828452045345983,
"density_atomic": 0.05374573362303177,
"volume": 148.84902411252497,
"volume_molar": 11.204872189928242,
"formula_full": "Ta6 Sb2",
"formula_reduced": "Ta3Sb",
"formula_anonymous": "AB3",
"energy_above_hull": 5.421963425,
"spacegroup": 223
},
{
"id": "jvasp-38850",
"created_at": "2022-09-04T14:37:58.112715Z",
"updated_at": "2022-09-04T14:37:58.112738Z",
"structure_string": "Hf2 Tc1 Os1\n1.0\n-0.000000 3.253462 3.253462\n3.253462 -0.000000 3.253462\n3.253462 3.253462 0.000000\nHf Tc Os\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.500001 Hf\n0.750000 0.750000 0.750000 Tc\n0.250000 0.250000 0.250000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Tc",
"Os"
],
"chemical_system": "Hf-Os-Tc",
"density": 15.555464205361817,
"density_atomic": 0.05807547624134979,
"volume": 68.8758880491452,
"volume_molar": 10.369507320048855,
"formula_full": "Hf2 Tc1 Os1",
"formula_reduced": "Hf2TcOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.422035625,
"spacegroup": 225
},
{
"id": "jvasp-111775",
"created_at": "2022-09-04T14:38:53.977574Z",
"updated_at": "2022-09-04T14:38:53.977605Z",
"structure_string": "Ta8 Ti8 Co8 C4\n1.0\n7.032884 -0.007983 -4.029031\n-2.366255 6.622867 -4.029031\n0.005632 0.007983 8.105216\nTa Ti Co C\n8 8 8 4\ndirect\n0.309385 0.309385 0.000000 Ta\n0.690616 0.690616 0.000001 Ta\n0.559990 0.059991 0.119980 Ta\n0.940009 0.440010 0.880021 Ta\n0.940009 0.059991 0.500000 Ta\n0.559990 0.440010 0.500000 Ta\n0.936104 0.436104 0.500000 Ta\n0.563896 0.063896 0.500000 Ta\n0.684760 0.315240 0.000000 Ti\n0.315240 0.684761 0.000001 Ti\n0.684760 0.684761 0.369521 Ti\n0.315240 0.315240 0.630480 Ti\n0.624502 0.877568 0.746935 Ti\n0.130633 0.877568 0.253066 Ti\n0.122433 0.375498 0.253066 Ti\n0.122433 0.869367 0.746935 Ti\n0.914125 0.749290 0.835165 Co\n0.921039 0.085875 0.835164 Co\n0.250710 0.085875 0.164836 Co\n0.914124 0.078961 0.164836 Co\n0.333601 0.002830 0.669227 Co\n0.335626 0.666399 0.669228 Co\n0.997170 0.666399 0.330773 Co\n0.333602 0.664374 0.330773 Co\n0.128366 0.376796 0.751569 C\n0.623204 0.871635 0.248432 C\n0.625227 0.376797 0.248432 C\n0.623204 0.374773 0.751569 C\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ta",
"Ti",
"Co",
"C"
],
"chemical_system": "C-Co-Ta-Ti",
"density": 10.328407067775645,
"density_atomic": 0.07410872715297351,
"volume": 377.8232480258776,
"volume_molar": 8.126088507186523,
"formula_full": "Ta8 Ti8 Co8 C4",
"formula_reduced": "Ta2Ti2Co2C",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 5.423285266666668,
"spacegroup": 119
},
{
"id": "jvasp-37154",
"created_at": "2022-09-04T14:38:08.176069Z",
"updated_at": "2022-09-04T14:38:08.176097Z",
"structure_string": "Nb3 Cr1\n1.0\n4.097444 0.000000 0.000000\n0.000000 4.097444 -0.000000\n-0.000000 0.000000 4.097444\nNb Cr\n3 1\ndirect\n0.000000 0.500000 0.500000 Nb\n0.500000 0.500000 0.000000 Nb\n0.500000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Cr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Cr"
],
"chemical_system": "Cr-Nb",
"density": 7.982965009605464,
"density_atomic": 0.058146142870963424,
"volume": 68.79218126087413,
"volume_molar": 10.356904968510458,
"formula_full": "Nb3 Cr1",
"formula_reduced": "Nb3Cr",
"formula_anonymous": "AB3",
"energy_above_hull": 5.424168900000001,
"spacegroup": 221
},
{
"id": "jvasp-41816",
"created_at": "2022-09-04T14:37:38.553603Z",
"updated_at": "2022-09-04T14:37:38.553627Z",
"structure_string": "Hf2 Re1 Ir1\n1.0\n-0.000000 3.266705 3.266705\n3.266705 0.000000 3.266705\n3.266705 3.266705 -0.000000\nHf Re Ir\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Hf\n0.750001 0.750001 0.750001 Re\n0.250001 0.250001 0.250001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Re",
"Ir"
],
"chemical_system": "Hf-Ir-Re",
"density": 17.515209559948463,
"density_atomic": 0.057372033574665686,
"volume": 69.7203803102827,
"volume_molar": 10.496648601731373,
"formula_full": "Hf2 Re1 Ir1",
"formula_reduced": "Hf2ReIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.425363774999999,
"spacegroup": 225
},
{
"id": "jvasp-39096",
"created_at": "2022-09-04T14:37:42.689966Z",
"updated_at": "2022-09-04T14:37:42.689988Z",
"structure_string": "Si1 Tc2 W1\n1.0\n0.000000 3.059258 3.059258\n3.059258 -0.000000 3.059258\n3.059258 3.059258 0.000000\nSi Tc W\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 Tc\n0.750001 0.750001 0.750001 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"Tc",
"W"
],
"chemical_system": "Si-Tc-W",
"density": 11.829098363695104,
"density_atomic": 0.06985245632810444,
"volume": 57.26355536033799,
"volume_molar": 8.621229769950197,
"formula_full": "Si1 Tc2 W1",
"formula_reduced": "SiTc2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.427452899999999,
"spacegroup": 225
},
{
"id": "jvasp-91990",
"created_at": "2022-09-04T14:35:54.981248Z",
"updated_at": "2022-09-04T14:35:54.981267Z",
"structure_string": "Re6 Ni2\n1.0\n5.425589 -0.000002 -0.000000\n-2.712796 4.698688 0.000000\n0.000000 -0.000000 4.380731\nRe Ni\n6 2\ndirect\n0.833252 0.166748 0.749999 Re\n0.333499 0.166749 0.749999 Re\n0.833252 0.666503 0.749999 Re\n0.166748 0.833252 0.250000 Re\n0.666504 0.833251 0.250000 Re\n0.166748 0.333496 0.250000 Re\n0.666666 0.333331 0.250000 Ni\n0.333335 0.666667 0.749999 Ni\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Re",
"Ni"
],
"chemical_system": "Ni-Re",
"density": 18.35758328667309,
"density_atomic": 0.0716341304229891,
"volume": 111.67860840581389,
"volume_molar": 8.40680374625913,
"formula_full": "Re6 Ni2",
"formula_reduced": "Re3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 5.428404099999999,
"spacegroup": 194
}
]
}