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{
"id": "jvasp-68024",
"created_at": "2022-09-04T14:36:15.420371Z",
"updated_at": "2022-09-04T14:36:15.420394Z",
"structure_string": "Mn1 Be1 V2\n1.0\n-1.701938 1.701938 3.964437\n1.701938 -1.701938 3.964437\n1.701938 1.701938 -3.964437\nMn Be V\n1 1 2\ndirect\n0.750001 0.250000 0.500000 Mn\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 V\n0.250000 0.750001 0.500000 V\n",
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{
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"structure_string": "Mn1 Be1 V2\n1.0\n2.948871 0.000000 0.000000\n0.000000 2.948871 0.000000\n0.000000 0.000000 5.234856\nMn Be V\n1 1 2\ndirect\n0.500000 0.500000 0.716746 Mn\n0.000000 0.000000 0.514885 Be\n0.000000 0.000000 0.988970 V\n0.500000 0.500000 0.279401 V\n",
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"formula_full": "Mn1 Be1 V2",
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{
"id": "jvasp-71841",
"created_at": "2022-09-04T14:35:58.817930Z",
"updated_at": "2022-09-04T14:35:58.817957Z",
"structure_string": "Mn2 Be1 V1\n1.0\n-1.667357 1.667357 3.923503\n1.667357 -1.667357 3.923503\n1.667357 1.667357 -3.923503\nMn Be V\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.250000 0.750001 0.500001 Mn\n0.750001 0.250000 0.500001 Be\n0.500000 0.500000 0.000000 V\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Be-Mn-V",
"density": 6.463559475310692,
"density_atomic": 0.09167877816948185,
"volume": 43.63059892230899,
"volume_molar": 6.5687402038312275,
"formula_full": "Mn2 Be1 V1",
"formula_reduced": "Mn2BeV",
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"spacegroup": 119
},
{
"id": "jvasp-67791",
"created_at": "2022-09-04T14:36:07.148642Z",
"updated_at": "2022-09-04T14:36:07.148657Z",
"structure_string": "Mn1 Be1 V1\n1.0\n-1.229206 1.229206 5.440942\n1.229206 -1.229206 5.440942\n1.229206 1.229206 -5.440942\nMn Be V\n1 1 1\ndirect\n0.349190 0.349190 0.000000 Mn\n0.993520 0.993520 0.000000 Be\n0.657288 0.657288 0.000000 V\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Be-Mn-V",
"density": 5.801688729060409,
"density_atomic": 0.09123003134293903,
"volume": 32.88390846565452,
"volume_molar": 6.601050850637573,
"formula_full": "Mn1 Be1 V1",
"formula_reduced": "MnBeV",
"formula_anonymous": "ABC",
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"spacegroup": 107
},
{
"id": "jvasp-67786",
"created_at": "2022-09-04T14:35:57.878779Z",
"updated_at": "2022-09-04T14:35:57.878799Z",
"structure_string": "Mn1 Be1 Tl1\n1.0\n-1.485820 1.485820 5.494084\n1.485820 -1.485820 5.494084\n1.485820 1.485820 -5.494084\nMn Be Tl\n1 1 1\ndirect\n0.368363 0.368363 0.000000 Mn\n0.967349 0.967349 0.000000 Be\n0.664287 0.664287 0.000000 Tl\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Be-Mn-Tl",
"density": 9.1840946377828,
"density_atomic": 0.06183488656749457,
"volume": 48.51630150118272,
"volume_molar": 9.739066559824055,
"formula_full": "Mn1 Be1 Tl1",
"formula_reduced": "MnBeTl",
"formula_anonymous": "ABC",
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"spacegroup": 107
},
{
"id": "jvasp-66967",
"created_at": "2022-09-04T14:35:51.524818Z",
"updated_at": "2022-09-04T14:35:51.524833Z",
"structure_string": "Mn1 Be1 Tl1\n1.0\n1.585788 -2.746665 -0.000000\n1.585788 2.746665 0.000000\n0.000000 0.000000 5.969752\nMn Be Tl\n1 1 1\ndirect\n0.666667 0.333334 0.288767 Mn\n0.000000 -0.000000 0.026198 Be\n0.333334 0.666667 0.685034 Tl\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Be-Mn-Tl",
"density": 8.56814742846826,
"density_atomic": 0.05768782283158294,
"volume": 52.00404266873388,
"volume_molar": 10.43918883467205,
"formula_full": "Mn1 Be1 Tl1",
"formula_reduced": "MnBeTl",
"formula_anonymous": "ABC",
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"spacegroup": 156
},
{
"id": "jvasp-70061",
"created_at": "2022-09-04T14:35:48.659790Z",
"updated_at": "2022-09-04T14:35:48.659815Z",
"structure_string": "Mn1 Be2 Tl1\n1.0\n-1.753073 1.753073 4.102352\n1.753073 -1.753073 4.102352\n1.753073 1.753073 -4.102352\nMn Be Tl\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
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],
"chemical_system": "Be-Mn-Tl",
"density": 9.132246658910363,
"density_atomic": 0.07931714545329886,
"volume": 50.430458347182444,
"volume_molar": 7.592482968951241,
"formula_full": "Mn1 Be2 Tl1",
"formula_reduced": "MnBe2Tl",
"formula_anonymous": "ABC2",
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"spacegroup": 119
},
{
"id": "jvasp-69787",
"created_at": "2022-09-04T14:36:09.488428Z",
"updated_at": "2022-09-04T14:36:09.488443Z",
"structure_string": "Mn1 Be2 Tl1\n1.0\n2.997678 0.000000 -0.000000\n0.000000 2.997678 0.000000\n-0.000000 0.000000 6.047413\nMn Be Tl\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.833717 Be\n0.000000 0.000000 0.166282 Be\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
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"elements": [
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],
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"density": 8.474829272991922,
"density_atomic": 0.07360721750566256,
"volume": 54.34249704782391,
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"formula_full": "Mn1 Be2 Tl1",
"formula_reduced": "MnBe2Tl",
"formula_anonymous": "ABC2",
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"spacegroup": 123
},
{
"id": "jvasp-66781",
"created_at": "2022-09-04T14:36:20.498097Z",
"updated_at": "2022-09-04T14:36:20.498125Z",
"structure_string": "Ti1 Mn1 Be2\n1.0\n-1.721518 1.721518 3.706192\n1.721518 -1.721518 3.706192\n1.721518 1.721518 -3.706192\nTi Mn Be\n1 1 2\ndirect\n0.750000 0.250000 0.500001 Ti\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500001 Be\n",
"nsites": 4,
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"elements": [
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],
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"density": 4.5667864850620035,
"density_atomic": 0.09104350098546975,
"volume": 43.93504156478327,
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"formula_full": "Ti1 Mn1 Be2",
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"spacegroup": 119
},
{
"id": "jvasp-68029",
"created_at": "2022-09-04T14:35:45.536765Z",
"updated_at": "2022-09-04T14:35:45.536793Z",
"structure_string": "Ti2 Mn1 Be1\n1.0\n-1.790632 1.790632 4.059946\n1.790632 -1.790632 4.059946\n1.790632 1.790632 -4.059946\nTi Mn Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.750000 0.500000 Ti\n0.750000 0.250000 0.500000 Mn\n0.500000 0.500000 0.000000 Be\n",
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"elements": [
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],
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"density": 5.092349309435401,
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"volume": 52.07064188664653,
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"formula_full": "Ti2 Mn1 Be1",
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},
{
"id": "jvasp-41799",
"created_at": "2022-09-04T14:37:32.372652Z",
"updated_at": "2022-09-04T14:37:32.372665Z",
"structure_string": "Ti2 Mn1 Be1\n1.0\n0.000001 2.958595 2.958595\n2.958602 -0.000000 2.958596\n2.958602 2.958596 0.000001\nTi Mn Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500002 0.500000 0.500001 Ti\n0.750004 0.749997 0.749997 Mn\n0.250000 0.250000 0.250000 Be\n",
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],
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"volume": 51.79496931113302,
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},
{
"id": "jvasp-66977",
"created_at": "2022-09-04T14:36:00.937564Z",
"updated_at": "2022-09-04T14:36:00.937590Z",
"structure_string": "Mn1 Be2 Te1\n1.0\n3.364178 0.000000 0.000000\n0.000000 3.364178 -0.000000\n-0.000000 0.000000 4.975757\nMn Be Te\n1 2 1\ndirect\n0.000000 0.000000 0.481481 Mn\n0.000000 0.000000 0.036263 Be\n0.500000 0.500000 0.239858 Be\n0.500000 0.500000 0.742400 Te\n",
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],
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}