CeMn2GeH8
Alexandria ALEXAlex-ID: agm007452912 · Space group: C2 (#5)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_1096_spg2
Mn3GeH CeMnH5 MnGe GeH8
2024-02-09 14:33:00
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007452912).
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
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# CIF generated by HEAS from Alexandria entry agm007452912
data_agm007452912
_cell_length_a 4.36613
_cell_length_b 4.36613
_cell_length_c 6.18720
_cell_angle_alpha 68.97429
_cell_angle_beta 68.97429
_cell_angle_gamma 57.22250
_cell_volume 90.50723
_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
Ce1 Ce 0.47891 0.52109 0.00000 1.00000
Mn1 Mn 0.25234 0.33671 0.63205 1.00000
Mn2 Mn 0.66329 0.74766 0.36795 1.00000
Ge1 Ge 0.96816 0.03184 0.50000 1.00000
H1 H 0.91029 0.93308 0.17480 1.00000
H2 H 0.80216 0.56852 0.62265 1.00000
H3 H 0.06692 0.08971 0.82520 1.00000
H4 H 0.43148 0.19784 0.37735 1.00000
H5 H 0.53919 0.09156 0.80607 1.00000
H6 H 0.42842 0.95339 0.16419 1.00000
H7 H 0.04661 0.57158 0.83581 1.00000
H8 H 0.90844 0.46081 0.19393 1.00000
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