Tm4CrAg
Alexandria ALEXAlex-ID: agm013446002 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_60_spg15
Tm Cr TmAg
2024-05-28 20:47:49.602592
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm013446002).
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 agm013446002
data_agm013446002
_cell_length_a 7.56538
_cell_length_b 7.56538
_cell_length_c 5.97857
_cell_angle_alpha 80.69721
_cell_angle_beta 80.69721
_cell_angle_gamma 112.34733
_cell_volume 302.84670
_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
Tm1 Tm 0.36697 0.20984 0.39445 1.00000
Tm2 Tm 0.06992 0.72203 0.54681 1.00000
Tm3 Tm 0.79016 0.63303 0.10555 1.00000
Tm4 Tm 0.27797 0.93008 0.95319 1.00000
Tm5 Tm 0.72203 0.06992 0.04681 1.00000
Tm6 Tm 0.20984 0.36697 0.89445 1.00000
Tm7 Tm 0.93008 0.27797 0.45319 1.00000
Tm8 Tm 0.63303 0.79016 0.60555 1.00000
Cr1 Cr 0.00057 0.99943 0.75000 1.00000
Cr2 Cr 0.99943 0.00057 0.25000 1.00000
Ag1 Ag 0.37442 0.62558 0.25000 1.00000
Ag2 Ag 0.62558 0.37442 0.75000 1.00000
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