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=1161",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1159",
"results": [
{
"id": "jvasp-102667",
"created_at": "2022-09-04T14:36:51.424172Z",
"updated_at": "2022-09-04T14:36:51.424193Z",
"structure_string": "Th2 Si3 Ir1\n1.0\n4.077228 -0.015865 -6.566246\n-0.311526 3.959645 -6.630519\n-0.001961 0.015865 7.729125\nTh Si Ir\n2 3 1\ndirect\n0.751514 0.251513 0.499999 Th\n0.001256 0.001256 -0.000000 Th\n0.583718 0.583717 -0.000002 Si\n0.331681 0.831680 0.499998 Si\n0.416756 0.416756 -0.000001 Si\n0.165076 0.665076 0.499999 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Th",
"density": 9.825599019208068,
"density_atomic": 0.04794099309545568,
"volume": 125.1538529469624,
"volume_molar": 12.561568651715806,
"formula_full": "Th2 Si3 Ir1",
"formula_reduced": "Th2Si3Ir",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.6879480166666654,
"spacegroup": 44
},
{
"id": "jvasp-102629",
"created_at": "2022-09-04T14:36:54.356309Z",
"updated_at": "2022-09-04T14:36:54.356336Z",
"structure_string": "Th2 Si2 Ir2\n1.0\n4.037216 -0.004556 -6.685538\n-0.317058 4.024749 -6.685538\n0.004216 0.004556 7.809962\nTh Si Ir\n2 2 2\ndirect\n0.578235 0.578234 -0.000000 Th\n0.328235 0.828235 0.500000 Th\n0.000279 0.000279 -0.000000 Si\n0.750280 0.250279 0.500000 Si\n0.168486 0.168486 -0.000000 Ir\n0.918487 0.418486 0.500000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Th",
"density": 11.816033357414234,
"density_atomic": 0.04719308133309637,
"volume": 127.13728009516974,
"volume_molar": 12.76064327627764,
"formula_full": "Th2 Si2 Ir2",
"formula_reduced": "ThSiIr",
"formula_anonymous": "ABC",
"energy_above_hull": 2.9401651,
"spacegroup": 109
},
{
"id": "jvasp-92575",
"created_at": "2022-09-04T14:36:00.810600Z",
"updated_at": "2022-09-04T14:36:00.810620Z",
"structure_string": "Th1 Si3 Ir1\n1.0\n4.311957 0.000000 0.000000\n0.000000 4.311957 0.000000\n-2.155979 -2.155979 4.879762\nTh Si Ir\n1 3 1\ndirect\n0.000316 0.000316 0.000630 Th\n0.410243 0.410243 0.820485 Si\n0.764132 0.264132 0.528264 Si\n0.264132 0.764132 0.528264 Si\n0.655179 0.655179 0.310356 Ir\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Th",
"density": 9.306844212994111,
"density_atomic": 0.05510899880172896,
"volume": 90.72928394124868,
"volume_molar": 10.927690378964144,
"formula_full": "Th1 Si3 Ir1",
"formula_reduced": "ThSi3Ir",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.5554364999999994,
"spacegroup": 107
},
{
"id": "jvasp-106326",
"created_at": "2022-09-04T14:38:13.965973Z",
"updated_at": "2022-09-04T14:38:13.965997Z",
"structure_string": "Th4 Si1 Ge1\n1.0\n5.860677 0.031355 -1.526439\n-3.494773 4.704794 -1.526439\n-0.015663 -0.031355 6.056179\nTh Si Ge\n4 1 1\ndirect\n0.914204 0.414203 0.828406 Th\n0.585797 0.085796 0.171593 Th\n0.085797 0.914203 0.500000 Th\n0.414204 0.585796 0.500000 Th\n0.500000 0.499999 -0.000000 Si\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ge"
],
"chemical_system": "Ge-Si-Th",
"density": 10.224805255688572,
"density_atomic": 0.035908182743631,
"volume": 167.0928334869359,
"volume_molar": 16.77094272075949,
"formula_full": "Th4 Si1 Ge1",
"formula_reduced": "Th4SiGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.133402825,
"spacegroup": 97
},
{
"id": "jvasp-106718",
"created_at": "2022-09-04T14:38:44.770568Z",
"updated_at": "2022-09-04T14:38:44.770598Z",
"structure_string": "Th4 Si2 Ge2\n1.0\n4.312478 0.000000 0.000000\n0.000000 5.942591 0.000000\n0.000000 0.000000 7.898988\nTh Si Ge\n4 2 2\ndirect\n-0.000000 0.115228 0.682873 Th\n-0.000000 0.884772 0.182872 Th\n0.500000 0.380515 0.318292 Th\n0.500000 0.619485 0.818292 Th\n0.500000 0.900746 0.456480 Si\n0.500000 0.099254 0.956480 Si\n-0.000000 0.601665 0.542356 Ge\n-0.000000 0.398335 0.042356 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ge"
],
"chemical_system": "Ge-Si-Th",
"density": 9.266182283733698,
"density_atomic": 0.039519896589352316,
"volume": 202.42967948846828,
"volume_molar": 15.23825029851551,
"formula_full": "Th4 Si2 Ge2",
"formula_reduced": "Th2SiGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4805489375,
"spacegroup": 26
},
{
"id": "jvasp-15664",
"created_at": "2022-09-04T14:36:38.910528Z",
"updated_at": "2022-09-04T14:36:38.910556Z",
"structure_string": "Th1 Si2 Cu2\n1.0\n3.867239 0.000000 -1.486194\n-0.571149 3.824830 -1.486194\n-0.011282 -0.013092 5.745230\nTh Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.621798 0.621798 0.243598 Si\n0.378202 0.378202 0.756403 Si\n0.750000 0.250000 0.500001 Cu\n0.250000 0.750000 0.500001 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Si",
"Cu"
],
"chemical_system": "Cu-Si-Th",
"density": 8.12945315040487,
"density_atomic": 0.05894123071884523,
"volume": 84.83026124531455,
"volume_molar": 10.21719547853714,
"formula_full": "Th1 Si2 Cu2",
"formula_reduced": "Th(CuSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.7679987399999997,
"spacegroup": 139
},
{
"id": "jvasp-16125",
"created_at": "2022-09-04T14:36:32.716841Z",
"updated_at": "2022-09-04T14:36:32.716870Z",
"structure_string": "Th1 Si1 Au1\n1.0\n2.157944 -3.737667 0.000000\n2.157944 3.737667 -0.000000\n-0.000000 0.000000 4.175742\nTh Si Au\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Th\n0.333332 0.666666 0.500000 Si\n0.666666 0.333332 0.500000 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Th",
"Si",
"Au"
],
"chemical_system": "Au-Si-Th",
"density": 11.267991488835467,
"density_atomic": 0.044536575970359156,
"volume": 67.36036470330853,
"volume_molar": 13.521786596275321,
"formula_full": "Th1 Si1 Au1",
"formula_reduced": "ThSiAu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7973172566666669,
"spacegroup": 187
},
{
"id": "jvasp-17378",
"created_at": "2022-09-04T14:38:28.229848Z",
"updated_at": "2022-09-04T14:38:28.229874Z",
"structure_string": "Th1 Si2 Au2\n1.0\n4.110347 0.000000 -1.575821\n-0.604137 4.065706 -1.575821\n-0.084943 -0.098496 5.927031\nTh Si Au\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.615281 0.615281 0.230561 Si\n0.384720 0.384719 0.769440 Si\n0.750001 0.250000 0.500000 Au\n0.250000 0.750000 0.500000 Au\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Si",
"Au"
],
"chemical_system": "Au-Si-Th",
"density": 11.585194043232567,
"density_atomic": 0.0511386551725761,
"volume": 97.77339633055756,
"volume_molar": 11.776103105717704,
"formula_full": "Th1 Si2 Au2",
"formula_reduced": "Th(SiAu)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.134663588,
"spacegroup": 139
},
{
"id": "jvasp-2700",
"created_at": "2022-09-04T14:36:49.546071Z",
"updated_at": "2022-09-04T14:36:49.546088Z",
"structure_string": "Th2 Se2 O2\n1.0\n4.047644 0.000000 0.000000\n-0.000000 4.047644 -0.000000\n0.000000 0.000000 7.072029\nTh Se O\n2 2 2\ndirect\n0.499999 0.000000 0.188780 Th\n0.000000 0.499999 0.811221 Th\n0.499999 0.000000 0.636979 Se\n0.000000 0.499999 0.363021 Se\n0.000000 0.000000 0.000000 O\n0.499999 0.499999 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Se",
"O"
],
"chemical_system": "O-Se-Th",
"density": 9.372918115329096,
"density_atomic": 0.05178483549258021,
"volume": 115.86403515484156,
"volume_molar": 11.629158812067404,
"formula_full": "Th2 Se2 O2",
"formula_reduced": "ThSeO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0824741555555557,
"spacegroup": 129
},
{
"id": "jvasp-91499",
"created_at": "2022-09-04T14:35:47.725032Z",
"updated_at": "2022-09-04T14:35:47.725056Z",
"structure_string": "Th4 Se8 O28\n1.0\n7.054938 0.014153 0.000000\n-2.038080 8.851224 0.000000\n0.000000 0.000000 9.652907\nTh Se O\n4 8 28\ndirect\n0.789971 0.132984 0.460006 Th\n0.789970 0.632983 0.039994 Th\n0.210030 0.867016 0.539994 Th\n0.210030 0.367016 0.960006 Th\n0.671966 0.248045 0.096142 Se\n0.877586 0.983260 0.819408 Se\n0.122414 0.516739 0.319408 Se\n0.671966 0.748044 0.403858 Se\n0.122414 0.016739 0.180592 Se\n0.328034 0.751955 0.903858 Se\n0.328034 0.251955 0.596142 Se\n0.877586 0.483260 0.680592 Se\n0.271941 0.646348 0.414872 O\n0.257492 0.474654 0.191258 O\n0.548528 0.889994 0.442589 O\n0.271941 0.146348 0.085128 O\n0.103644 0.124585 0.562084 O\n0.952612 0.136793 0.915250 O\n0.451472 0.110005 0.557411 O\n0.896356 0.875414 0.437917 O\n0.952612 0.636793 0.584751 O\n0.060478 0.406437 0.732448 O\n0.896356 0.375414 0.062083 O\n0.728059 0.353651 0.585129 O\n0.060478 0.906437 0.767552 O\n0.742508 0.025346 0.691259 O\n0.658716 0.245775 0.273082 O\n0.341284 0.754225 0.726919 O\n0.257492 0.974653 0.308742 O\n0.728059 0.853651 0.914872 O\n0.939522 0.093562 0.232448 O\n0.341284 0.254225 0.773082 O\n0.548528 0.389994 0.057411 O\n0.047388 0.363206 0.415250 O\n0.451472 0.610005 0.942589 O\n0.103644 0.624585 0.937917 O\n0.742508 0.525346 0.808742 O\n0.047388 0.863206 0.084750 O\n0.939522 0.593562 0.267552 O\n0.658716 0.745774 0.226918 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Th",
"Se",
"O"
],
"chemical_system": "O-Se-Th",
"density": 5.528631781067924,
"density_atomic": 0.06632920166667572,
"volume": 603.0526373739893,
"volume_molar": 9.079169669888502,
"formula_full": "Th4 Se8 O28",
"formula_reduced": "ThSe2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.582640683333333,
"spacegroup": 14
},
{
"id": "jvasp-2631",
"created_at": "2022-09-04T14:36:58.339475Z",
"updated_at": "2022-09-04T14:36:58.339498Z",
"structure_string": "Th2 Se1 N2\n1.0\n2.024220 -3.506051 0.000000\n2.024220 3.506051 0.000000\n0.000000 0.000000 7.199295\nTh Se N\n2 1 2\ndirect\n0.666667 0.333333 0.704546 Th\n0.333333 0.666667 0.295454 Th\n0.000000 0.000000 0.000000 Se\n0.333333 0.666667 0.627651 N\n0.666667 0.333333 0.372350 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Se",
"N"
],
"chemical_system": "N-Se-Th",
"density": 9.27955098444548,
"density_atomic": 0.04892987410026992,
"volume": 102.18706039900515,
"volume_molar": 12.307697231468614,
"formula_full": "Th2 Se1 N2",
"formula_reduced": "Th2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.509576213333333,
"spacegroup": 164
},
{
"id": "jvasp-79968",
"created_at": "2022-09-04T14:37:03.725922Z",
"updated_at": "2022-09-04T14:37:03.725941Z",
"structure_string": "Th1 Sc1 Tc2\n1.0\n0.000000 3.387793 3.387793\n3.387793 -0.000000 3.387793\n3.387793 3.387793 -0.000000\nTh Sc Tc\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Th\n0.250000 0.250000 0.250000 Sc\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"Sc",
"Tc"
],
"chemical_system": "Sc-Tc-Th",
"density": 10.100063605903363,
"density_atomic": 0.051437446006794105,
"volume": 77.76435866336872,
"volume_molar": 11.707697849548298,
"formula_full": "Th1 Sc1 Tc2",
"formula_reduced": "ThScTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.1630809625,
"spacegroup": 225
}
]
}