Pa5Ge
Alexandria ALEXAlex-ID: agm001192551 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5_8_spg65
Pa7Ge Pa5Ge4
2021-05-15 21:43:21
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm001192551).
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 agm001192551
data_agm001192551
_cell_length_a 4.40433
_cell_length_b 4.59782
_cell_length_c 7.29379
_cell_angle_alpha 108.37213
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 140.17321
_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
Ge1 Ge 0.00000 0.00000 0.00000 1.00000
Pa1 Pa 0.00000 0.66033 0.32065 1.00000
Pa2 Pa 0.00000 0.33967 0.67935 1.00000
Pa3 Pa 0.50000 0.50000 0.00000 1.00000
Pa4 Pa 0.50000 0.16052 0.32103 1.00000
Pa5 Pa 0.50000 0.83948 0.67897 1.00000
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