Pm3Ag2Ru
Alexandria ALEXAlex-ID: agm040950722 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_467_spg2
Pm2AgRu PmAg
2025-04-15 08:49:48
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm040950722).
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 agm040950722
data_agm040950722
_cell_length_a 5.14061
_cell_length_b 8.03922
_cell_length_c 8.29601
_cell_angle_alpha 67.02326
_cell_angle_beta 71.96681
_cell_angle_gamma 71.40053
_cell_volume 292.35391
_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
Pm1 Pm 0.09689 0.57629 0.23048 1.00000
Pm2 Pm 0.24827 0.72897 0.77408 1.00000
Pm3 Pm 0.90311 0.42371 0.76952 1.00000
Pm4 Pm 0.57942 0.07765 0.76359 1.00000
Pm5 Pm 0.42058 0.92235 0.23641 1.00000
Pm6 Pm 0.75173 0.27103 0.22592 1.00000
Ag1 Ag 0.00000 0.00000 0.00000 1.00000
Ag2 Ag 0.50000 0.50000 0.50000 1.00000
Ag3 Ag 0.83497 0.83918 0.48965 1.00000
Ag4 Ag 0.16503 0.16082 0.51035 1.00000
Ru1 Ru 0.33588 0.33066 0.99905 1.00000
Ru2 Ru 0.66412 0.66934 0.00095 1.00000
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