CsHoBeO3
Alexandria ALEXAlex-ID: agm005032007 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD3_1_spg11
Cs2BeO2 Ho2O3 BeO
2022-07-05 12:03:12.591012
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005032007).
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 agm005032007
data_agm005032007
_cell_length_a 3.44516
_cell_length_b 8.20613
_cell_length_c 7.95393
_cell_angle_alpha 112.59996
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 207.60168
_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
Cs1 Cs 0.25000 0.21260 0.24136 1.00000
Cs2 Cs 0.75000 0.78740 0.75864 1.00000
Ho1 Ho 0.25000 0.66484 0.15850 1.00000
Ho2 Ho 0.75000 0.33516 0.84150 1.00000
Be1 Be 0.25000 0.06261 0.60634 1.00000
Be2 Be 0.75000 0.93739 0.39366 1.00000
O1 O 0.75000 0.85787 0.18193 1.00000
O2 O 0.25000 0.14213 0.81807 1.00000
O3 O 0.25000 0.86890 0.45785 1.00000
O4 O 0.75000 0.13110 0.54215 1.00000
O5 O 0.75000 0.48008 0.14467 1.00000
O6 O 0.25000 0.51992 0.85533 1.00000
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