Pm4Y4Tm3
Alexandria ALEXAlex-ID: agm005703301 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_146_spg12
PmY2 Pm5Y PmTm2
2023-06-30 01:36:40.516894
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005703301).
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 agm005703301
data_agm005703301
_cell_length_a 3.61085
_cell_length_b 9.27655
_cell_length_c 12.06883
_cell_angle_alpha 112.60152
_cell_angle_beta 98.60095
_cell_angle_gamma 90.00002
_cell_volume 368.28350
_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 0.64183 0.46314 0.28360 1.00000
Pm2 Pm 0.35817 0.17954 0.71640 1.00000
Pm3 Pm 0.35817 0.53686 0.71640 1.00000
Pm4 Pm 0.64183 0.82046 0.28360 1.00000
Y1 Y 0.74100 0.24102 0.48205 1.00000
Y2 Y 0.25900 0.75898 0.51795 1.00000
Y3 Y 0.50000 0.81826 1.00000 1.00000
Y4 Y 0.50000 0.18174 0.00000 1.00000
Tm1 Tm 0.89175 0.89174 0.78349 1.00000
Tm2 Tm 0.10825 0.10826 0.21651 1.00000
Tm3 Tm 0.00000 0.50000 0.00000 1.00000
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