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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=3843",
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"results": [
{
"id": "jvasp-102300",
"created_at": "2022-09-04T14:37:03.924383Z",
"updated_at": "2022-09-04T14:37:03.924420Z",
"structure_string": "Tb4 Co2 Ge4\n1.0\n5.072361 0.006102 2.461757\n3.342267 3.815512 2.461757\n-0.091766 -0.041677 10.231212\nTb Co Ge\n4 2 4\ndirect\n0.810811 0.810809 0.116016 Tb\n0.189190 0.189189 0.883985 Tb\n0.994508 0.994505 0.333107 Tb\n0.005493 0.005493 0.666894 Tb\n0.274787 0.274786 0.342776 Co\n0.725214 0.725212 0.657224 Co\n0.515022 0.515020 0.121987 Ge\n0.484979 0.484978 0.878014 Ge\n0.659562 0.659561 0.439250 Ge\n0.340438 0.340437 0.560750 Ge\n",
"nsites": 10,
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],
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"volume": 198.84075148663842,
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"formula_full": "Tb4 Co2 Ge4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 12
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{
"id": "jvasp-100270",
"created_at": "2022-09-04T14:36:35.125697Z",
"updated_at": "2022-09-04T14:36:35.125725Z",
"structure_string": "Tb4 Co2 Si4\n1.0\n5.027824 0.000090 2.564525\n3.311862 3.782935 2.564525\n0.019499 0.008845 10.046327\nTb Co Si\n4 2 4\ndirect\n0.001834 0.001833 0.328238 Tb\n-0.001833 -0.001835 0.671762 Tb\n0.813689 0.813688 0.105000 Tb\n0.186312 0.186310 0.895000 Tb\n0.726637 0.726635 0.621536 Co\n0.273364 0.273362 0.378464 Co\n0.654853 0.654852 0.432729 Si\n0.345147 0.345146 0.567271 Si\n0.504891 0.504890 0.127164 Si\n0.495110 0.495107 0.872835 Si\n",
"nsites": 10,
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"elements": [
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],
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"volume": 190.8493684514607,
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"formula_full": "Tb4 Co2 Si4",
"formula_reduced": "Tb2CoSi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.49620098,
"spacegroup": 12
},
{
"id": "jvasp-35444",
"created_at": "2022-09-04T14:37:47.037972Z",
"updated_at": "2022-09-04T14:37:47.037996Z",
"structure_string": "Tb2 Cr2 C3\n1.0\n0.000000 -3.412298 0.000000\n-4.983439 1.706149 1.413928\n-0.022034 0.000000 -5.588035\nTb Cr C\n2 2 3\ndirect\n0.395765 0.791529 0.683123 Tb\n0.604235 0.208470 0.316877 Tb\n0.157537 0.315073 0.891039 Cr\n0.842463 0.684926 0.108961 Cr\n0.711120 0.422238 0.773022 C\n0.288881 0.577761 0.226978 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Tb",
"Cr",
"C"
],
"chemical_system": "C-Cr-Tb",
"density": 7.992363332665664,
"density_atomic": 0.07358295584538552,
"volume": 95.13072585326128,
"volume_molar": 8.184151738418723,
"formula_full": "Tb2 Cr2 C3",
"formula_reduced": "Tb2Cr2C3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 4.9215488,
"spacegroup": 12
},
{
"id": "jvasp-10719",
"created_at": "2022-09-04T14:38:03.266038Z",
"updated_at": "2022-09-04T14:38:03.266064Z",
"structure_string": "Tb2 Cu1 Ge4 O12\n1.0\n-4.955198 0.022558 0.011979\n1.628237 7.091567 -0.042566\n-0.408300 -3.169023 -7.317357\nTb Cu Ge O\n2 1 4 12\ndirect\n0.949821 0.767956 0.546860 Tb\n0.050179 0.232045 0.453140 Tb\n0.000000 0.000000 0.000000 Cu\n0.460221 0.833240 0.222588 Ge\n0.539779 0.166761 0.777412 Ge\n0.417938 0.617236 0.796283 Ge\n0.582062 0.382766 0.203718 Ge\n0.250361 0.988586 0.798519 O\n0.749809 0.771592 0.809733 O\n0.250191 0.228409 0.190267 O\n0.260017 0.690664 0.011207 O\n0.407462 0.342077 0.711405 O\n0.220295 0.578325 0.603987 O\n0.779705 0.421676 0.396014 O\n0.749639 0.011416 0.201482 O\n0.772942 0.065288 0.611191 O\n0.227058 0.934713 0.388810 O\n0.592538 0.657924 0.288596 O\n0.739983 0.309337 0.988794 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Tb",
"Cu",
"Ge",
"O"
],
"chemical_system": "Cu-Ge-O-Tb",
"density": 5.559618127430817,
"density_atomic": 0.07363106940733444,
"volume": 258.0432438769849,
"volume_molar": 8.178803877864269,
"formula_full": "Tb2 Cu1 Ge4 O12",
"formula_reduced": "Tb2Cu(GeO3)4",
"formula_anonymous": "AB2C4D12",
"energy_above_hull": 2.177768581578947,
"spacegroup": 2
},
{
"id": "jvasp-109307",
"created_at": "2022-09-04T14:38:19.900265Z",
"updated_at": "2022-09-04T14:38:19.900286Z",
"structure_string": "Tb2 Cu1 Ir1\n1.0\n4.218420 -0.000000 2.435506\n1.406140 3.977165 2.435506\n-0.000000 -0.000000 4.871012\nTb Cu Ir\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Tb\n0.750000 0.749999 0.750001 Tb\n0.500000 0.499999 0.500001 Cu\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Cu",
"Ir"
],
"chemical_system": "Cu-Ir-Tb",
"density": 11.655367915204478,
"density_atomic": 0.048946018004245966,
"volume": 81.72268476779885,
"volume_molar": 12.303637773919814,
"formula_full": "Tb2 Cu1 Ir1",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-54882",
"created_at": "2022-09-04T14:37:14.783088Z",
"updated_at": "2022-09-04T14:37:14.783114Z",
"structure_string": "Tb2 Fe17\n1.0\n6.208269 0.036009 0.801378\n0.709152 6.167738 0.801378\n0.040151 0.036009 6.259648\nTb Fe\n2 17\ndirect\n0.655674 0.655674 0.655674 Tb\n0.344326 0.344326 0.344326 Tb\n0.295623 0.704377 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.846777 0.336521 0.336521 Fe\n0.336520 0.846777 0.336521 Fe\n0.663479 0.663480 0.153224 Fe\n-0.000000 0.000000 0.500000 Fe\n-0.000000 0.295623 0.704377 Fe\n0.336520 0.336521 0.846777 Fe\n0.295623 0.000000 0.704377 Fe\n-0.000000 0.704377 0.295623 Fe\n0.704377 0.295623 0.000000 Fe\n0.704377 0.000000 0.295623 Fe\n0.909528 0.909529 0.909529 Fe\n0.663479 0.153224 0.663480 Fe\n0.090472 0.090472 0.090472 Fe\n0.500000 0.000000 0.000000 Fe\n0.153223 0.663480 0.663480 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
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"Fe"
],
"chemical_system": "Fe-Tb",
"density": 8.798100740799825,
"density_atomic": 0.07944066830147924,
"volume": 239.17220746299043,
"volume_molar": 7.580677364326583,
"formula_full": "Tb2 Fe17",
"formula_reduced": "Tb2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.063990542105263,
"spacegroup": 166
},
{
"id": "jvasp-85252",
"created_at": "2022-09-04T14:37:16.363657Z",
"updated_at": "2022-09-04T14:37:16.363682Z",
"structure_string": "Tb2 Fe17\n1.0\n6.208488 0.035807 0.801177\n0.708975 6.167977 0.801177\n0.039925 0.035807 6.259841\nTb Fe\n2 17\ndirect\n0.655654 0.655655 0.655654 Tb\n0.344346 0.344347 0.344346 Tb\n0.295676 0.704323 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.846779 0.336502 0.336502 Fe\n0.336501 0.846780 0.336502 Fe\n0.663498 0.663500 0.153221 Fe\n0.000000 0.000000 0.500000 Fe\n0.000000 0.295678 0.704323 Fe\n0.336502 0.336502 0.846779 Fe\n0.295678 0.000001 0.704323 Fe\n-0.000000 0.704323 0.295677 Fe\n0.704323 0.295678 0.000000 Fe\n0.704323 0.000001 0.295677 Fe\n0.909537 0.909538 0.909538 Fe\n0.663499 0.153222 0.663499 Fe\n0.090463 0.090463 0.090463 Fe\n0.500000 0.000000 0.000000 Fe\n0.153221 0.663500 0.663499 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
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"Fe"
],
"chemical_system": "Fe-Tb",
"density": 8.797066098635833,
"density_atomic": 0.07943132620965945,
"volume": 239.20033702886175,
"volume_molar": 7.581568944353925,
"formula_full": "Tb2 Fe17",
"formula_reduced": "Tb2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.063985278947369,
"spacegroup": 166
},
{
"id": "jvasp-112628",
"created_at": "2022-09-04T14:38:42.284793Z",
"updated_at": "2022-09-04T14:38:42.284810Z",
"structure_string": "Tb2 Fe17 C2\n1.0\n6.292368 0.012564 0.726286\n0.670974 6.256505 0.726286\n0.026401 0.023769 6.376387\nTb Fe C\n2 17 2\ndirect\n0.647322 0.647322 0.667811 Tb\n0.352677 0.352677 0.332191 Tb\n0.500000 -0.000000 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.724530 0.275470 0.000001 Fe\n0.997752 0.718854 0.282521 Fe\n0.281145 0.002248 0.717481 Fe\n0.002248 0.281145 0.717481 Fe\n0.718855 0.997751 0.282521 Fe\n0.275470 0.724529 0.000001 Fe\n0.146839 0.655942 0.661799 Fe\n0.655942 0.146839 0.661799 Fe\n0.656430 0.656429 0.140855 Fe\n0.853160 0.344057 0.338203 Fe\n0.344057 0.853159 0.338203 Fe\n0.343570 0.343570 0.859147 Fe\n0.092981 0.092981 0.090704 Fe\n0.907018 0.907017 0.909298 Fe\n0.500000 -0.000000 0.500001 C\n-0.000000 0.500000 0.500001 C\n",
"nsites": 21,
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"elements": [
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"C"
],
"chemical_system": "C-Fe-Tb",
"density": 8.550722060647844,
"density_atomic": 0.08374656282720867,
"volume": 250.75655992388081,
"volume_molar": 7.1909109540713585,
"formula_full": "Tb2 Fe17 C2",
"formula_reduced": "Tb2Fe17C2",
"formula_anonymous": "A2B2C17",
"energy_above_hull": 4.42172049047619,
"spacegroup": 12
},
{
"id": "jvasp-8110",
"created_at": "2022-09-04T14:37:05.668051Z",
"updated_at": "2022-09-04T14:37:05.668071Z",
"structure_string": "Tb2 Fe2 Si2 C1\n1.0\n3.690766 0.000000 1.362577\n1.495225 5.213617 1.629751\n-0.000166 -0.011800 5.680260\nTb Fe Si C\n2 2 2 1\ndirect\n0.940634 0.324680 0.794051 Tb\n0.059365 0.675320 0.205949 Tb\n0.699894 0.194044 0.406168 Fe\n0.300105 0.805956 0.593833 Fe\n0.664429 0.890439 0.780699 Si\n0.335569 0.109561 0.219301 Si\n0.499999 0.500000 0.500000 C\n",
"nsites": 7,
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"elements": [
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"C"
],
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"density": 7.558250710800215,
"density_atomic": 0.06401519157441381,
"volume": 109.34904399782856,
"volume_molar": 9.407361927519382,
"formula_full": "Tb2 Fe2 Si2 C1",
"formula_reduced": "Tb2Fe2Si2C",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 3.487275,
"spacegroup": 12
},
{
"id": "jvasp-52097",
"created_at": "2022-09-04T14:38:19.595398Z",
"updated_at": "2022-09-04T14:38:19.595421Z",
"structure_string": "Tb4 Fe2 Si4\n1.0\n4.033647 -0.000000 0.953209\n1.963267 5.285944 0.703236\n0.005625 -0.062907 8.987293\nTb Fe Si\n4 2 4\ndirect\n0.188913 0.728774 0.893400 Tb\n0.811088 0.271225 0.106600 Tb\n0.997865 0.332197 0.672074 Tb\n0.002136 0.667802 0.327926 Tb\n0.726743 0.923456 0.623058 Fe\n0.273257 0.076543 0.376942 Fe\n0.500719 0.126558 0.872003 Si\n0.499282 0.873441 0.127997 Si\n0.340901 0.752104 0.566095 Si\n0.659100 0.247894 0.433906 Si\n",
"nsites": 10,
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"elements": [
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],
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"density": 7.448866302561525,
"density_atomic": 0.052176781071839554,
"volume": 191.6561312249506,
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"formula_full": "Tb4 Fe2 Si4",
"formula_reduced": "Tb2FeSi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.5379219,
"spacegroup": 12
},
{
"id": "jvasp-34157",
"created_at": "2022-09-04T14:37:20.173187Z",
"updated_at": "2022-09-04T14:37:20.173216Z",
"structure_string": "Tb4 Fe2 Si4\n1.0\n4.033695 -0.000000 0.953221\n1.963289 5.286039 0.703252\n0.005618 -0.062897 8.987429\nTb Fe Si\n4 2 4\ndirect\n0.188914 0.728772 0.893402 Tb\n0.811088 0.271227 0.106598 Tb\n0.997867 0.332198 0.672072 Tb\n0.002136 0.667802 0.327928 Tb\n0.726743 0.923456 0.623061 Fe\n0.273259 0.076544 0.376939 Fe\n0.500724 0.126554 0.872000 Si\n0.499278 0.873445 0.127999 Si\n0.340898 0.752112 0.566094 Si\n0.659104 0.247888 0.433906 Si\n",
"nsites": 10,
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"elements": [
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],
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"density": 7.448530042911849,
"density_atomic": 0.052174425687085454,
"volume": 191.6647834319193,
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"formula_full": "Tb4 Fe2 Si4",
"formula_reduced": "Tb2FeSi2",
"formula_anonymous": "AB2C2",
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"spacegroup": 12
},
{
"id": "jvasp-118960",
"created_at": "2022-09-04T14:38:49.622707Z",
"updated_at": "2022-09-04T14:38:49.622731Z",
"structure_string": "Tb2 Ga8 Fe1\n1.0\n4.231501 -0.000000 0.000000\n0.000000 4.231501 0.000000\n-0.000000 0.000000 11.225185\nTb Ga Fe\n2 8 1\ndirect\n0.000000 0.000000 0.695270 Tb\n0.000000 0.000000 0.304729 Tb\n0.500000 0.000000 0.885505 Ga\n-0.000000 0.500000 0.885505 Ga\n0.500000 0.000000 0.114495 Ga\n-0.000000 0.500000 0.114495 Ga\n0.500000 0.000000 0.500000 Ga\n-0.000000 0.500000 0.500000 Ga\n0.500000 0.500000 0.695594 Ga\n0.500000 0.500000 0.304406 Ga\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 11,
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"elements": [
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],
"chemical_system": "Fe-Ga-Tb",
"density": 7.6955575291848515,
"density_atomic": 0.05472808881587953,
"volume": 200.9936805395681,
"volume_molar": 11.003747600725015,
"formula_full": "Tb2 Ga8 Fe1",
"formula_reduced": "Tb2Ga8Fe",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.2629564454545454,
"spacegroup": 123
}
]
}