Ho2Tm3Pd4
Alexandria ALEXAlex-ID: agm005684550 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_99_spg14
Ho2Pd TmPd
2023-06-27 22:19:19.169792
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005684550).
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 agm005684550
data_agm005684550
_cell_length_a 7.60700
_cell_length_b 7.57505
_cell_length_c 7.56696
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 108.90267
_cell_volume 412.51885
_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
Ho1 Ho 0.57977 0.19415 0.32149 1.00000
Ho2 Ho 0.92023 0.80585 0.82149 1.00000
Ho3 Ho 0.42023 0.80585 0.67851 1.00000
Ho4 Ho 0.07977 0.19415 0.17851 1.00000
Tm1 Tm 0.00000 0.50000 0.50000 1.00000
Tm2 Tm 0.50000 0.50000 0.00000 1.00000
Tm3 Tm 0.74923 0.24147 0.83546 1.00000
Tm4 Tm 0.75077 0.75853 0.33546 1.00000
Tm5 Tm 0.25077 0.75853 0.16454 1.00000
Tm6 Tm 0.24923 0.24147 0.66454 1.00000
Pd1 Pd 0.85857 0.08803 0.53623 1.00000
Pd2 Pd 0.64143 0.91197 0.03623 1.00000
Pd3 Pd 0.14143 0.91197 0.46377 1.00000
Pd4 Pd 0.35857 0.08803 0.96377 1.00000
Pd5 Pd 0.86898 0.49519 0.13332 1.00000
Pd6 Pd 0.63102 0.50481 0.63332 1.00000
Pd7 Pd 0.13102 0.50481 0.86668 1.00000
Pd8 Pd 0.36898 0.49519 0.36668 1.00000
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