Er6TaGe8
Alexandria ALEXAlex-ID: agm072936337 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_0_spg148
Er3Ge4 Er2Ta3Ge4 ErGe
2024-10-06 07:24:00.449898
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072936337).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm072936337
data_agm072936337
_cell_length_a 7.37211
_cell_length_b 7.37211
_cell_length_c 7.37211
_cell_angle_alpha 67.80215
_cell_angle_beta 67.80215
_cell_angle_gamma 67.80215
_cell_volume 330.30566
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Er1 Er 0.83955 0.59378 0.34025 1.00000
Er2 Er 0.59378 0.34025 0.83955 1.00000
Er3 Er 0.34025 0.83955 0.59378 1.00000
Er4 Er 0.16045 0.40622 0.65975 1.00000
Er5 Er 0.40622 0.65975 0.16045 1.00000
Er6 Er 0.65975 0.16045 0.40622 1.00000
Ta1 Ta 0.00000 0.00000 0.00000 1.00000
Ge1 Ge 0.71323 0.71323 0.71323 1.00000
Ge2 Ge 0.28677 0.28677 0.28677 1.00000
Ge3 Ge 0.14710 0.59783 0.96093 1.00000
Ge4 Ge 0.59783 0.96093 0.14710 1.00000
Ge5 Ge 0.96093 0.14710 0.59783 1.00000
Ge6 Ge 0.85290 0.40217 0.03907 1.00000
Ge7 Ge 0.40217 0.03907 0.85290 1.00000
Ge8 Ge 0.03907 0.85290 0.40217 1.00000
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