Pm3Ho6Tl
Alexandria ALEXAlex-ID: agm005996622 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_300_spg11
Pm3Ho2Tl3 Pm3Ho5 Pm2Ho7
2023-09-20 00:20:26
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005996622).
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 agm005996622
data_agm005996622
_cell_length_a 3.50929
_cell_length_b 12.77623
_cell_length_c 14.33237
_cell_angle_alpha 101.13093
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 630.51096
_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 0.75000 0.42206 0.90232 1.00000
Pm2 Pm 0.25000 0.57794 0.09768 1.00000
Pm3 Pm 0.75000 0.63210 0.50542 1.00000
Pm4 Pm 0.25000 0.36790 0.49458 1.00000
Pm5 Pm 0.75000 0.07606 0.10072 1.00000
Pm6 Pm 0.25000 0.92394 0.89928 1.00000
Ho1 Ho 0.75000 0.48759 0.69045 1.00000
Ho2 Ho 0.25000 0.51241 0.30955 1.00000
Ho3 Ho 0.75000 0.80919 0.07835 1.00000
Ho4 Ho 0.25000 0.19081 0.92165 1.00000
Ho5 Ho 0.75000 0.34298 0.11713 1.00000
Ho6 Ho 0.25000 0.65702 0.88287 1.00000
Ho7 Ho 0.75000 0.75763 0.31279 1.00000
Ho8 Ho 0.25000 0.24237 0.68721 1.00000
Ho9 Ho 0.75000 0.10869 0.45920 1.00000
Ho10 Ho 0.25000 0.89131 0.54080 1.00000
Ho11 Ho 0.75000 0.77255 0.71645 1.00000
Ho12 Ho 0.25000 0.22745 0.28355 1.00000
Tl1 Tl 0.75000 0.03525 0.72663 1.00000
Tl2 Tl 0.25000 0.96475 0.27337 1.00000
