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=-elements&page=1115",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1113",
"results": [
{
"id": "jvasp-75723",
"created_at": "2022-09-04T14:36:13.743822Z",
"updated_at": "2022-09-04T14:36:13.743845Z",
"structure_string": "Ti1 Mo2 As1\n1.0\n0.000000 3.140867 3.140867\n3.140867 -0.000000 3.140867\n3.140867 3.140867 -0.000000\nTi Mo As\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Ti\n0.000000 0.000000 0.000000 Mo\n0.250000 0.250000 0.250000 Mo\n0.500001 0.500001 0.500001 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mo",
"As"
],
"chemical_system": "As-Mo-Ti",
"density": 8.431869375533491,
"density_atomic": 0.06454778680420448,
"volume": 61.969591802324196,
"volume_molar": 9.329740116833461,
"formula_full": "Ti1 Mo2 As1",
"formula_reduced": "TiMo2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.5216704708333335,
"spacegroup": 216
},
{
"id": "jvasp-75588",
"created_at": "2022-09-04T14:35:51.781326Z",
"updated_at": "2022-09-04T14:35:51.781344Z",
"structure_string": "Ti2 Mo1 As1\n1.0\n-0.000000 3.136402 3.136402\n3.136402 0.000000 3.136402\n3.136402 3.136402 -0.000000\nTi Mo As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 Ti\n0.750000 0.750000 0.750000 Mo\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mo",
"As"
],
"chemical_system": "As-Mo-Ti",
"density": 7.174256713525283,
"density_atomic": 0.06482385124458884,
"volume": 61.70568275722279,
"volume_molar": 9.290007681397514,
"formula_full": "Ti2 Mo1 As1",
"formula_reduced": "Ti2MoAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.939406079166667,
"spacegroup": 216
},
{
"id": "jvasp-79988",
"created_at": "2022-09-04T14:36:53.040332Z",
"updated_at": "2022-09-04T14:36:53.040361Z",
"structure_string": "Ti1 Mn2 W1\n1.0\n-0.000000 2.973901 2.973901\n2.973901 0.000000 2.973901\n2.973901 2.973901 -0.000000\nTi Mn W\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Ti\n0.000000 0.000000 0.000000 Mn\n0.500001 0.500001 0.500001 Mn\n0.750000 0.750000 0.750000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"W"
],
"chemical_system": "Mn-Ti-W",
"density": 10.782909094350424,
"density_atomic": 0.07604146492252054,
"volume": 52.60287928534311,
"volume_molar": 7.9195485859406105,
"formula_full": "Ti1 Mn2 W1",
"formula_reduced": "TiMn2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.978115704022988,
"spacegroup": 225
},
{
"id": "jvasp-39672",
"created_at": "2022-09-04T14:37:46.499249Z",
"updated_at": "2022-09-04T14:37:46.499273Z",
"structure_string": "Ti1 Mn2 V1\n1.0\n0.000008 2.914735 2.914737\n2.914734 0.000007 2.914738\n2.914732 2.914734 0.000009\nTi Mn V\n1 2 1\ndirect\n0.250002 0.250001 0.250000 Ti\n0.000003 0.999998 0.000000 Mn\n0.500000 0.500001 0.499999 Mn\n0.750003 0.750001 0.749999 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"V"
],
"chemical_system": "Mn-Ti-V",
"density": 6.997034934991712,
"density_atomic": 0.08076711231187551,
"volume": 49.52510849409016,
"volume_molar": 7.4561793626420645,
"formula_full": "Ti1 Mn2 V1",
"formula_reduced": "TiMn2V",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.086419254022989,
"spacegroup": 225
},
{
"id": "jvasp-110046",
"created_at": "2022-09-04T14:38:16.633620Z",
"updated_at": "2022-09-04T14:38:16.633635Z",
"structure_string": "Ti2 Mn1 Tc1\n1.0\n3.720786 -0.000000 2.148197\n1.240262 3.507991 2.148197\n-0.000000 -0.000000 4.296394\nTi Mn Tc\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 Mn\n0.750000 0.750000 0.750000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Tc"
],
"chemical_system": "Mn-Tc-Ti",
"density": 7.363406881163114,
"density_atomic": 0.07132844019815902,
"volume": 56.07861308739567,
"volume_molar": 8.442832540946872,
"formula_full": "Ti2 Mn1 Tc1",
"formula_reduced": "Ti2MnTc",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.237291352011495,
"spacegroup": 225
},
{
"id": "jvasp-111728",
"created_at": "2022-09-04T14:38:52.179970Z",
"updated_at": "2022-09-04T14:38:52.179979Z",
"structure_string": "Ti3 Mn3 Sn12\n1.0\n5.637991 0.000000 0.000000\n-2.818995 4.882644 -0.000000\n0.000000 0.000000 14.137960\nTi Mn Sn\n3 3 12\ndirect\n0.500000 -0.000000 0.500000 Ti\n0.000000 0.500000 0.166667 Ti\n0.500000 0.500000 0.833333 Ti\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.166667 Mn\n0.000000 0.000000 0.833333 Mn\n0.500000 0.500000 0.217586 Sn\n0.000000 0.500000 0.782414 Sn\n0.000000 0.500000 0.550919 Sn\n0.500000 -0.000000 0.884252 Sn\n0.832989 0.167011 0.333333 Sn\n0.832989 0.665977 0.000000 Sn\n0.334022 0.167011 0.666667 Sn\n0.500000 -0.000000 0.115748 Sn\n0.665978 0.832988 0.666667 Sn\n0.167011 0.334022 0.000000 Sn\n0.167012 0.832988 0.333333 Sn\n0.500000 0.500000 0.449081 Sn\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn-Ti",
"density": 7.393757750380937,
"density_atomic": 0.046249422878912365,
"volume": 389.1940456668311,
"volume_molar": 13.021007366441808,
"formula_full": "Ti3 Mn3 Sn12",
"formula_reduced": "TiMnSn4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.7853837291187742,
"spacegroup": 180
},
{
"id": "jvasp-37059",
"created_at": "2022-09-04T14:38:02.526255Z",
"updated_at": "2022-09-04T14:38:02.526288Z",
"structure_string": "Ti2 Mn1 Sn1\n1.0\n3.160014 3.160014 -0.000000\n3.160014 -0.000000 -3.160014\n0.000000 3.160014 -3.160014\nTi Mn Sn\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.749999 0.749999 0.749999 Ti\n0.499999 0.499999 0.499999 Mn\n0.250000 0.250000 0.250000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn-Ti",
"density": 7.0879513371283425,
"density_atomic": 0.06338156749380679,
"volume": 63.109830794116164,
"volume_molar": 9.501407109548753,
"formula_full": "Ti2 Mn1 Sn1",
"formula_reduced": "Ti2MnSn",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0545714020114945,
"spacegroup": 216
},
{
"id": "jvasp-97804",
"created_at": "2022-09-04T14:38:08.186446Z",
"updated_at": "2022-09-04T14:38:08.186473Z",
"structure_string": "Ti12 Mn12 Si24\n1.0\n7.695616 0.000000 0.000000\n0.000000 8.684696 -0.000000\n0.000000 0.000000 9.495653\nTi Mn Si\n12 12 24\ndirect\n0.239634 0.828146 0.453141 Ti\n0.239634 0.171855 0.546859 Ti\n0.760366 0.328146 0.046859 Ti\n0.760366 0.671855 0.953140 Ti\n0.760366 0.171855 0.546859 Ti\n0.760366 0.828146 0.453141 Ti\n0.239634 0.671855 0.953140 Ti\n0.239634 0.328146 0.046859 Ti\n0.000000 0.331107 0.320638 Ti\n0.000000 0.668893 0.679362 Ti\n0.000000 0.831107 0.179362 Ti\n0.000000 0.168893 0.820638 Ti\n0.243692 0.500000 0.500000 Mn\n0.248167 0.584415 0.246861 Mn\n0.248167 0.415586 0.753139 Mn\n0.751833 0.084415 0.253139 Mn\n0.751833 0.915586 0.746861 Mn\n0.751833 0.415586 0.753139 Mn\n0.751833 0.584415 0.246861 Mn\n0.248167 0.915586 0.746861 Mn\n0.243692 0.000000 0.000000 Mn\n0.756309 0.500000 0.500000 Mn\n0.248167 0.084415 0.253139 Mn\n0.756309 0.000000 0.000000 Mn\n0.500000 0.037001 0.377065 Si\n0.654969 0.331777 0.317725 Si\n0.000000 0.462269 0.879224 Si\n0.000000 0.537731 0.120776 Si\n0.000000 0.962270 0.620776 Si\n0.000000 0.037731 0.379224 Si\n0.000000 0.370433 0.602715 Si\n0.000000 0.629567 0.397285 Si\n0.000000 0.870434 0.897285 Si\n0.500000 0.374357 0.595715 Si\n0.500000 0.625644 0.404285 Si\n0.345031 0.168223 0.817724 Si\n0.500000 0.874357 0.904285 Si\n0.500000 0.462999 0.877065 Si\n0.500000 0.537001 0.122935 Si\n0.500000 0.962999 0.622935 Si\n0.000000 0.129567 0.102715 Si\n0.345031 0.331777 0.317725 Si\n0.654969 0.831778 0.182275 Si\n0.345031 0.831778 0.182275 Si\n0.654969 0.168223 0.817724 Si\n0.654969 0.668223 0.682275 Si\n0.500000 0.125643 0.095715 Si\n0.345031 0.668223 0.682275 Si\n",
"nsites": 48,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 4.991593221353005,
"density_atomic": 0.07563423031699588,
"volume": 634.6332844113552,
"volume_molar": 7.962189520221448,
"formula_full": "Ti12 Mn12 Si24",
"formula_reduced": "TiMnSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4386831936781608,
"spacegroup": 55
},
{
"id": "jvasp-39655",
"created_at": "2022-09-04T14:37:42.298210Z",
"updated_at": "2022-09-04T14:37:42.298229Z",
"structure_string": "Ti1 Mn2 Si1\n1.0\n0.000000 2.891954 2.891954\n2.891954 -0.000000 2.891954\n2.891954 2.891954 0.000000\nTi Mn Si\n1 2 1\ndirect\n0.749998 0.749998 0.749998 Ti\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 6.379071813636646,
"density_atomic": 0.08269054485780472,
"volume": 48.373124241452636,
"volume_molar": 7.2827440795749006,
"formula_full": "Ti1 Mn2 Si1",
"formula_reduced": "TiMn2Si",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.736800354022988,
"spacegroup": 225
},
{
"id": "jvasp-79210",
"created_at": "2022-09-04T14:37:12.395681Z",
"updated_at": "2022-09-04T14:37:12.395700Z",
"structure_string": "Ti2 Mn1 Si1\n1.0\n-3.007021 -3.007021 -0.000000\n-3.007021 0.000000 -3.007021\n-0.000000 -3.007021 -3.007021\nTi Mn Si\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750000 0.750000 0.750000 Ti\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 5.458509872705881,
"density_atomic": 0.0735564248315098,
"volume": 54.38002199213054,
"volume_molar": 8.187103674212644,
"formula_full": "Ti2 Mn1 Si1",
"formula_reduced": "Ti2MnSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.669378127011494,
"spacegroup": 216
},
{
"id": "jvasp-37047",
"created_at": "2022-09-04T14:38:07.452778Z",
"updated_at": "2022-09-04T14:38:07.452807Z",
"structure_string": "Ti2 Mn1 Si1\n1.0\n3.006863 3.006863 -0.000000\n3.006863 0.000000 -3.006863\n0.000000 3.006863 -3.006863\nTi Mn Si\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.749999 0.749999 0.749999 Ti\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 5.459370393999089,
"density_atomic": 0.07356802082955614,
"volume": 54.37145046034716,
"volume_molar": 8.185813199939435,
"formula_full": "Ti2 Mn1 Si1",
"formula_reduced": "Ti2MnSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.669318127011494,
"spacegroup": 216
},
{
"id": "jvasp-99914",
"created_at": "2022-09-04T14:36:33.254612Z",
"updated_at": "2022-09-04T14:36:33.254633Z",
"structure_string": "Ti2 Mn2 Sb2\n1.0\n4.552322 -0.000000 0.000000\n-2.276161 3.942428 -0.000000\n0.000000 0.000000 5.588674\nTi Mn Sb\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.749999 Mn\n0.666667 0.333333 0.250000 Mn\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.749999 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Sb"
],
"chemical_system": "Mn-Sb-Ti",
"density": 7.4355950306736975,
"density_atomic": 0.05981990642116351,
"volume": 100.30105961311362,
"volume_molar": 10.067118322788689,
"formula_full": "Ti2 Mn2 Sb2",
"formula_reduced": "TiMnSb",
"formula_anonymous": "ABC",
"energy_above_hull": 2.820760558237548,
"spacegroup": 194
}
]
}