La2Pr3Tm5
Alexandria ALEXAlex-ID: agm005606837 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_183_spg15
La3Pr5 PrTm2 LaTm2
2023-06-24 18:32:55.467683
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005606837).
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 agm005606837
data_agm005606837
_cell_length_a 9.32235
_cell_length_b 9.32066
_cell_length_c 11.26021
_cell_angle_alpha 124.00382
_cell_angle_beta 124.00719
_cell_angle_gamma 69.44039
_cell_volume 671.32336
_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
La1 La 0.76723 0.02071 0.74217 1.00000
La2 La 0.23277 0.97929 0.25783 1.00000
La3 La 0.47493 0.72146 0.74217 1.00000
La4 La 0.52507 0.27854 0.25783 1.00000
Pr1 Pr 0.23093 0.98093 0.96186 1.00000
Pr2 Pr 0.76907 0.01907 0.03814 1.00000
Pr3 Pr 0.72676 0.48062 0.25371 1.00000
Pr4 Pr 0.27324 0.51938 0.74629 1.00000
Pr5 Pr 0.02694 0.77309 0.25371 1.00000
Pr6 Pr 0.97306 0.22691 0.74629 1.00000
Tm1 Tm 0.27263 0.52263 0.04526 1.00000
Tm2 Tm 0.72737 0.47737 0.95474 1.00000
Tm3 Tm 0.02635 0.77635 0.55270 1.00000
Tm4 Tm 0.52702 0.27702 0.55405 1.00000
Tm5 Tm 0.97365 0.22365 0.44730 1.00000
Tm6 Tm 0.47298 0.72298 0.44595 1.00000
Tm7 Tm 0.86925 0.61135 0.72965 1.00000
Tm8 Tm 0.13075 0.38865 0.27035 1.00000
Tm9 Tm 0.36040 0.11830 0.72965 1.00000
Tm10 Tm 0.63960 0.88170 0.27035 1.00000
