CaTm2PuSb4
Alexandria ALEXAlex-ID: agm004863779 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_343_spg10
Ca5Sb4 Pu4Sb3 TmSb PuSb2
2022-07-18 01:48:48.686005
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004863779).
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 agm004863779
data_agm004863779
_cell_length_a 4.40561
_cell_length_b 7.65225
_cell_length_c 7.59432
_cell_angle_alpha 70.79905
_cell_angle_beta 89.99972
_cell_angle_gamma 89.99968
_cell_volume 241.78357
_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
Ca1 Ca 0.00000 0.49999 0.50000 1.00000
Tm1 Tm 0.00000 0.00000 1.00000 1.00000
Tm2 Tm 0.50000 0.00000 0.50000 1.00000
Pu1 Pu 0.50000 0.50000 1.00000 1.00000
Sb1 Sb 0.00000 0.75679 0.75137 1.00000
Sb2 Sb 1.00000 0.24322 0.24863 1.00000
Sb3 Sb 0.50000 0.75940 0.24198 1.00000
Sb4 Sb 0.50000 0.24060 0.75802 1.00000
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