La(Ho2Tm3)2
Alexandria ALEXAlex-ID: agm006089441 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C6_271_spg63
HoTm2 HoTm5 LaHo2
2023-10-05 19:20:58
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006089441).
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 agm006089441
data_agm006089441
_cell_length_a 5.61368
_cell_length_b 5.58679
_cell_length_c 25.45633
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.15936
_cell_volume 690.29745
_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 0.82911 0.65822 0.25000 1.00000
La2 La 0.17089 0.34178 0.75000 1.00000
Ho1 Ho 0.83495 0.66991 0.54120 1.00000
Ho2 Ho 0.49432 0.98863 0.12173 1.00000
Ho3 Ho 0.16505 0.33009 0.45880 1.00000
Ho4 Ho 0.50568 0.01137 0.87827 1.00000
Ho5 Ho 0.83495 0.66991 0.95880 1.00000
Ho6 Ho 0.16505 0.33009 0.04120 1.00000
Ho7 Ho 0.50568 0.01137 0.62173 1.00000
Ho8 Ho 0.49432 0.98863 0.37827 1.00000
Tm1 Tm 0.50000 0.00000 0.00000 1.00000
Tm2 Tm 0.50000 0.00000 0.50000 1.00000
Tm3 Tm 0.16172 0.32344 0.32003 1.00000
Tm4 Tm 0.83828 0.67656 0.67997 1.00000
Tm5 Tm 0.83828 0.67656 0.82003 1.00000
Tm6 Tm 0.16172 0.32344 0.17997 1.00000
Tm7 Tm 0.82883 0.65767 0.39971 1.00000
Tm8 Tm 0.17117 0.34233 0.60029 1.00000
Tm9 Tm 0.17117 0.34233 0.89971 1.00000
Tm10 Tm 0.82883 0.65767 0.10029 1.00000
Tm11 Tm 0.49537 0.99075 0.25000 1.00000
Tm12 Tm 0.50463 0.00925 0.75000 1.00000
