Sr4Ac2Co
Alexandria ALEXAlex-ID: agm017294951 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_1904_spg12
Ac3Co AcCo Sr
2024-12-17 10:48:25
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017294951).
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
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# CIF generated by HEAS from Alexandria entry agm017294951
data_agm017294951
_cell_length_a 9.57749
_cell_length_b 9.57749
_cell_length_c 8.35523
_cell_angle_alpha 77.21414
_cell_angle_beta 102.78586
_cell_angle_gamma 154.77707
_cell_volume 318.08994
_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
Sr1 Sr 0.83924 0.16076 0.42238 1.00000
Sr2 Sr 0.16076 0.83924 0.57762 1.00000
Sr3 Sr 0.83569 0.16431 0.91489 1.00000
Sr4 Sr 0.16431 0.83569 0.08511 1.00000
Ac1 Ac 0.50095 0.49905 0.77211 1.00000
Ac2 Ac 0.49905 0.50095 0.22789 1.00000
Co1 Co 0.00000 0.00000 0.00000 1.00000
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