Ac(ThPt2)2
Alexandria ALEXAlex-ID: agm014514746 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_169_spg71
Ac(ThPt2)2
2024-11-08 18:27:30.163031
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm014514746).
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 agm014514746
data_agm014514746
_cell_length_a 10.31480
_cell_length_b 10.31480
_cell_length_c 10.31480
_cell_angle_alpha 157.51557
_cell_angle_beta 155.58466
_cell_angle_gamma 33.43031
_cell_volume 173.32110
_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
Ac1 Ac 0.50000 0.00000 0.50000 1.00000
Th1 Th 0.18155 0.18155 0.00000 1.00000
Th2 Th 0.81845 0.81845 0.00000 1.00000
Pt1 Pt 0.33232 0.33232 0.00000 1.00000
Pt2 Pt 0.66768 0.66768 0.00000 1.00000
Pt3 Pt 0.93062 0.43062 0.50000 1.00000
Pt4 Pt 0.06938 0.56938 0.50000 1.00000
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