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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=3840",
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"results": [
{
"id": "jvasp-62535",
"created_at": "2022-09-04T14:36:10.982438Z",
"updated_at": "2022-09-04T14:36:10.982460Z",
"structure_string": "Tb10 B2 Br15\n1.0\n8.959075 -0.008841 0.000092\n-3.459518 9.088318 0.005814\n-4.379009 -1.895159 9.392372\nTb B Br\n10 2 15\ndirect\n0.275094 0.924338 0.950473 Tb\n0.801544 0.411473 0.279987 Tb\n0.674888 0.743523 0.819693 Tb\n0.325111 0.256477 0.180306 Tb\n0.525020 0.701587 0.096606 Tb\n0.198454 0.588527 0.720012 Tb\n0.584016 0.038123 0.325717 Tb\n0.415983 0.961877 0.674282 Tb\n0.724905 0.075662 0.049526 Tb\n0.474979 0.298413 0.903394 Tb\n0.532573 0.181780 0.123800 B\n0.467425 0.818220 0.876200 B\n0.717897 0.243622 0.819958 Br\n0.356615 0.116464 0.418168 Br\n0.885973 0.295833 0.534421 Br\n0.114026 0.704167 0.465578 Br\n0.282102 0.756378 0.180041 Br\n0.062490 0.348107 0.232564 Br\n0.841855 0.942396 0.301516 Br\n0.594524 0.541865 0.350937 Br\n0.405475 0.458135 0.649062 Br\n0.777181 0.592730 0.059227 Br\n0.222818 0.407270 0.940772 Br\n0.643384 0.883536 0.581831 Br\n0.158144 0.057604 0.698483 Br\n0.937509 0.651893 0.767435 Br\n0.000000 0.000000 0.000000 Br\n",
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],
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"formula_full": "Tb10 B2 Br15",
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"formula_anonymous": "A2B10C15",
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"spacegroup": 2
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{
"id": "jvasp-112344",
"created_at": "2022-09-04T14:38:26.385718Z",
"updated_at": "2022-09-04T14:38:26.385744Z",
"structure_string": "Tb10 Si3 Sb3\n1.0\n8.742918 0.000000 0.000000\n-4.371460 7.571589 0.000000\n-0.000000 -0.000000 6.348959\nTb Si Sb\n10 3 3\ndirect\n0.757770 -0.000000 -0.000000 Tb\n0.000000 0.757770 -0.000000 Tb\n0.242230 0.242230 -0.000000 Tb\n0.244000 -0.000000 0.500000 Tb\n0.000000 0.244000 0.500000 Tb\n0.756001 0.756001 0.500000 Tb\n0.333333 0.666667 0.260102 Tb\n0.666667 0.333333 0.260102 Tb\n0.666667 0.333333 0.739898 Tb\n0.333333 0.666667 0.739898 Tb\n0.611934 -0.000000 0.500000 Si\n0.000000 0.611934 0.500000 Si\n0.388066 0.388066 0.500000 Si\n0.394323 -0.000000 -0.000000 Sb\n0.000000 0.394323 -0.000000 Sb\n0.605677 0.605677 -0.000000 Sb\n",
"nsites": 16,
"nelements": 3,
"elements": [
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"Si",
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],
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"density": 8.055187111079965,
"density_atomic": 0.0380692239203254,
"volume": 420.28700226424894,
"volume_molar": 15.818921795210914,
"formula_full": "Tb10 Si3 Sb3",
"formula_reduced": "Tb10(SiSb)3",
"formula_anonymous": "A3B3C10",
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"spacegroup": 189
},
{
"id": "jvasp-37405",
"created_at": "2022-09-04T14:38:06.755447Z",
"updated_at": "2022-09-04T14:38:06.755483Z",
"structure_string": "Tb2 Ag1 Ir1\n1.0\n-0.000000 3.513200 3.513200\n3.513200 -0.000000 3.513200\n3.513200 3.513200 -0.000000\nTb Ag Ir\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Tb\n0.250000 0.250000 0.250000 Ag\n0.749999 0.749999 0.749999 Ir\n",
"nsites": 4,
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"elements": [
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"Ag",
"Ir"
],
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"density": 11.831884092074892,
"density_atomic": 0.0461234063164826,
"volume": 86.723863639936,
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"formula_full": "Tb2 Ag1 Ir1",
"formula_reduced": "Tb2AgIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.63117879,
"spacegroup": 225
},
{
"id": "jvasp-110985",
"created_at": "2022-09-04T14:38:35.888140Z",
"updated_at": "2022-09-04T14:38:35.888177Z",
"structure_string": "Tb2 Ag1 Pd1\n1.0\n3.557265 0.000000 0.000000\n0.000000 3.557265 0.000000\n0.000000 0.000000 7.172176\nTb Ag Pd\n2 1 1\ndirect\n0.500001 0.500001 0.261569 Tb\n0.500001 0.500001 0.738432 Tb\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.500000 Pd\n",
"nsites": 4,
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"elements": [
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],
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"density": 9.736227831901843,
"density_atomic": 0.04407340601892085,
"volume": 90.75767818540703,
"volume_molar": 13.663887827082561,
"formula_full": "Tb2 Ag1 Pd1",
"formula_reduced": "Tb2AgPd",
"formula_anonymous": "ABC2",
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"spacegroup": 123
},
{
"id": "jvasp-121958",
"created_at": "2022-09-04T14:38:53.476978Z",
"updated_at": "2022-09-04T14:38:53.477014Z",
"structure_string": "Tb8 Al4\n1.0\n5.088296 0.000000 0.000000\n0.000000 6.531842 0.000000\n-0.000000 -0.000000 9.486450\nTb Al\n8 4\ndirect\n0.250000 0.811574 0.926127 Tb\n0.250000 0.311574 0.573873 Tb\n0.750001 0.188426 0.073873 Tb\n0.750001 0.688426 0.426127 Tb\n0.250000 0.973117 0.291076 Tb\n0.250000 0.473117 0.208924 Tb\n0.750001 0.026883 0.708924 Tb\n0.750001 0.526882 0.791076 Tb\n0.250000 0.291279 0.897512 Al\n0.250000 0.791278 0.602488 Al\n0.750001 0.708721 0.102488 Al\n0.750001 0.208721 0.397512 Al\n",
"nsites": 12,
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"elements": [
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"chemical_system": "Al-Tb",
"density": 7.264490996999863,
"density_atomic": 0.03806006148939365,
"volume": 315.2911353898913,
"volume_molar": 15.822729980817854,
"formula_full": "Tb8 Al4",
"formula_reduced": "Tb2Al",
"formula_anonymous": "AB2",
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"spacegroup": 62
},
{
"id": "jvasp-110986",
"created_at": "2022-09-04T14:38:39.941879Z",
"updated_at": "2022-09-04T14:38:39.941890Z",
"structure_string": "Tb2 Al3 Co1\n1.0\n4.709425 0.008151 2.568298\n1.528453 4.454502 2.568298\n0.011394 0.008151 5.364206\nTb Al Co\n2 3 1\ndirect\n0.626189 0.626189 0.626191 Tb\n0.373811 0.373811 0.373812 Tb\n-0.000000 0.500000 0.000000 Al\n0.500001 -0.000000 0.000000 Al\n-0.000000 -0.000000 0.500001 Al\n0.000000 0.000000 0.000000 Co\n",
"nsites": 6,
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"elements": [
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],
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"volume": 112.26754595525422,
"volume_molar": 11.26818274203849,
"formula_full": "Tb2 Al3 Co1",
"formula_reduced": "Tb2Al3Co",
"formula_anonymous": "AB2C3",
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"spacegroup": 166
},
{
"id": "jvasp-110987",
"created_at": "2022-09-04T14:38:39.067906Z",
"updated_at": "2022-09-04T14:38:39.067943Z",
"structure_string": "Tb2 Al3 Fe1\n1.0\n4.740872 0.002248 2.565625\n1.529796 4.487270 2.565625\n0.003140 0.002248 5.390573\nTb Al Fe\n2 3 1\ndirect\n0.626319 0.626320 0.626318 Tb\n0.373681 0.373681 0.373680 Tb\n0.000000 0.500000 -0.000001 Al\n0.500000 0.000000 -0.000000 Al\n-0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 6,
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"Fe"
],
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"density": 6.587474470611371,
"density_atomic": 0.05235439596969966,
"volume": 114.60355694816013,
"volume_molar": 11.502645858974939,
"formula_full": "Tb2 Al3 Fe1",
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"formula_anonymous": "AB2C3",
"energy_above_hull": 2.0299034500000004,
"spacegroup": 166
},
{
"id": "jvasp-116922",
"created_at": "2022-09-04T14:38:52.154407Z",
"updated_at": "2022-09-04T14:38:52.154430Z",
"structure_string": "Tb4 Al6 Ge8\n1.0\n7.961909 0.029630 0.000000\n-5.685633 5.573728 0.000000\n0.000000 0.000000 7.923222\nTb Al Ge\n4 6 8\ndirect\n0.114828 0.885172 0.419533 Tb\n0.885172 0.114828 0.580467 Tb\n0.385173 0.614828 0.919533 Tb\n0.614828 0.385172 0.080467 Tb\n0.534753 0.965248 0.250000 Al\n0.465248 0.034752 0.750000 Al\n0.965248 0.534753 0.750000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.034753 0.465248 0.250000 Al\n0.313831 0.686170 0.555847 Ge\n0.206148 0.293852 0.250000 Ge\n0.293852 0.206148 0.750000 Ge\n0.793852 0.706148 0.750000 Ge\n0.706149 0.793852 0.250000 Ge\n0.186170 0.813830 0.055847 Ge\n0.813830 0.186170 0.944152 Ge\n0.686170 0.313830 0.444153 Ge\n",
"nsites": 18,
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"elements": [
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],
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"density": 6.486521702982134,
"density_atomic": 0.050999058498139044,
"volume": 352.9476921746863,
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"formula_anonymous": "A2B3C4",
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"spacegroup": 64
},
{
"id": "jvasp-101103",
"created_at": "2022-09-04T14:36:35.478673Z",
"updated_at": "2022-09-04T14:36:35.478693Z",
"structure_string": "Tb2 Al3 Pt1\n1.0\n4.771654 0.011018 2.624223\n1.556700 4.510597 2.624223\n0.015421 0.011018 5.445641\nTb Al Pt\n2 3 1\ndirect\n0.625280 0.625282 0.625280 Tb\n0.374719 0.374720 0.374719 Tb\n-0.000000 0.500000 -0.000000 Al\n0.500000 0.000000 -0.000000 Al\n-0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 6,
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"elements": [
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"formula_full": "Tb2 Al3 Pt1",
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"formula_anonymous": "AB2C3",
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"spacegroup": 166
},
{
"id": "jvasp-86397",
"created_at": "2022-09-04T14:36:17.050256Z",
"updated_at": "2022-09-04T14:36:17.050280Z",
"structure_string": "Tb2 Al3 Si2\n1.0\n4.070192 -0.000000 -0.000000\n-2.035097 5.034680 -0.989154\n-0.000000 0.001427 6.663221\nTb Al Si\n2 3 2\ndirect\n0.380357 0.760716 0.678563 Tb\n0.619642 0.239285 0.321438 Tb\n0.694581 0.389162 0.866200 Al\n0.000000 0.000000 0.000000 Al\n0.305418 0.610839 0.133800 Al\n0.906700 0.813404 0.360613 Si\n0.093299 0.186597 0.639387 Si\n",
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"elements": [
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],
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"density_atomic": 0.051263562137342525,
"volume": 136.54923123067383,
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"formula_full": "Tb2 Al3 Si2",
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"formula_anonymous": "A2B2C3",
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"spacegroup": 12
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{
"id": "jvasp-85901",
"created_at": "2022-09-04T14:35:56.200132Z",
"updated_at": "2022-09-04T14:35:56.200161Z",
"structure_string": "Tb2 Al3 Si2\n1.0\n4.070173 0.000000 -0.000000\n-2.035087 5.034654 -0.989127\n-0.000000 0.001462 6.663214\nTb Al Si\n2 3 2\ndirect\n0.380363 0.760727 0.678554 Tb\n0.619635 0.239272 0.321445 Tb\n0.694600 0.389200 0.866200 Al\n0.000000 0.000000 0.000000 Al\n0.305398 0.610799 0.133799 Al\n0.906700 0.813403 0.360611 Si\n0.093298 0.186595 0.639387 Si\n",
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"formula_anonymous": "A2B2C3",
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},
{
"id": "jvasp-86288",
"created_at": "2022-09-04T14:35:56.387056Z",
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"structure_string": "Tb2 Al4 Ni1 Ge2\n1.0\n4.069120 0.000000 -0.850538\n-0.177781 4.065234 -0.850538\n-0.001019 -0.001065 10.154078\nTb Al Ni Ge\n2 4 1 2\ndirect\n0.813585 0.813583 0.627169 Tb\n0.186415 0.186415 0.372831 Tb\n0.932593 0.432591 0.865185 Al\n0.432593 0.932591 0.865185 Al\n0.567407 0.067407 0.134815 Al\n0.067407 0.567407 0.134814 Al\n0.000000 0.000000 0.000000 Ni\n0.662839 0.662838 0.325678 Ge\n0.337161 0.337160 0.674322 Ge\n",
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}