Er2H5Pd
Alexandria ALEXAlex-ID: agm002280392 · Space group: I4mm (#107)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C5_25_spg107
Er4HPd12 ErH2 ErH3
2018-12-31 12:53:34
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002280392).
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 agm002280392
data_agm002280392
_cell_length_a 5.00522
_cell_length_b 4.95021
_cell_length_c 5.00522
_cell_angle_alpha 120.21684
_cell_angle_beta 90.18430
_cell_angle_gamma 120.21976
_cell_volume 86.96418
_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
H1 H 0.71956 0.95554 0.23540 1.00000
H2 H 0.23474 0.95441 0.23471 1.00000
H3 H 0.72022 0.95517 0.72020 1.00000
H4 H 0.23532 0.95543 0.71953 1.00000
H5 H 0.27384 0.54760 0.27380 1.00000
Pd1 Pd 0.02089 0.04117 0.02093 1.00000
Er1 Er 0.75914 0.51834 0.25930 1.00000
Er2 Er 0.25929 0.51834 0.75914 1.00000
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