La6Pm2Pu
Alexandria ALEXAlex-ID: agm005683630 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_1778_spg12
La7Pm LaPm Pu
2023-07-08 18:40:49.817517
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005683630).
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 agm005683630
data_agm005683630
_cell_length_a 7.60961
_cell_length_b 10.48951
_cell_length_c 10.48951
_cell_angle_alpha 49.27880
_cell_angle_beta 92.08928
_cell_angle_gamma 92.08932
_cell_volume 634.06135
_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 0.64275 0.56655 0.56617 1.00000
La2 La 0.85725 0.43383 0.43345 1.00000
La3 La 0.35725 0.43345 0.43383 1.00000
La4 La 0.14275 0.56617 0.56655 1.00000
La5 La 0.97098 0.92361 0.32987 1.00000
La6 La 0.52902 0.67013 0.07639 1.00000
La7 La 0.02902 0.07639 0.67013 1.00000
La8 La 0.47098 0.32987 0.92361 1.00000
La9 La 0.02911 0.67025 0.07626 1.00000
La10 La 0.47089 0.92374 0.32975 1.00000
La11 La 0.97089 0.32975 0.92374 1.00000
La12 La 0.52911 0.07626 0.67025 1.00000
Pm1 Pm 0.27356 0.74016 0.74017 1.00000
Pm2 Pm 0.22644 0.25983 0.25984 1.00000
Pm3 Pm 0.72644 0.25984 0.25983 1.00000
Pm4 Pm 0.77356 0.74017 0.74016 1.00000
Pu1 Pu 0.25000 0.00038 0.99962 1.00000
Pu2 Pu 0.75000 0.99962 0.00038 1.00000
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