PmTmZn4
Alexandria ALEXAlex-ID: agm005764232 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_512_spg44
PmZn2 TmZn2
2023-07-31 15:56:19.050818
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005764232).
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 agm005764232
data_agm005764232
_cell_length_a 4.48987
_cell_length_b 5.71975
_cell_length_c 5.71976
_cell_angle_alpha 76.85719
_cell_angle_beta 66.89059
_cell_angle_gamma 66.89058
_cell_volume 123.79331
_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 0.00000 0.50000 0.50000 1.00000
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Zn1 Zn 0.66629 0.58916 0.07826 1.00000
Zn2 Zn 0.33371 0.92174 0.41084 1.00000
Zn3 Zn 0.33371 0.41084 0.92174 1.00000
Zn4 Zn 0.66629 0.07826 0.58916 1.00000
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