Er6Ag3Ir2Pd
Alexandria ALEXAlex-ID: agm036636352 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_407_spg2
Er4Ag3Pd Er5Ir3 ErAg2 ErPd
2025-02-25 20:52:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm036636352).
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 agm036636352
data_agm036636352
_cell_length_a 7.79102
_cell_length_b 7.79102
_cell_length_c 8.71394
_cell_angle_alpha 57.50843
_cell_angle_beta 122.49157
_cell_angle_gamma 143.18918
_cell_volume 261.24530
_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
Er1 Er 0.09324 0.90676 0.27057 1.00000
Er2 Er 0.24599 0.75401 0.72821 1.00000
Er3 Er 0.90676 0.09324 0.72943 1.00000
Er4 Er 0.42257 0.57743 0.26787 1.00000
Er5 Er 0.75401 0.24599 0.27179 1.00000
Er6 Er 0.57743 0.42257 0.73213 1.00000
Ag1 Ag 0.83552 0.16448 0.00593 1.00000
Ag2 Ag 0.16448 0.83552 0.99407 1.00000
Ag3 Ag 0.50000 0.50000 0.00000 1.00000
Ir1 Ir 0.66410 0.33590 0.50157 1.00000
Ir2 Ir 0.33590 0.66410 0.49843 1.00000
Pd1 Pd 0.00000 0.00000 0.50000 1.00000
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