Ca2CdAg3
Alexandria ALEXAlex-ID: agm005667010 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_139_spg8
CaAg2 CaCdAg
2023-08-07 06:15:09.381195
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005667010).
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 agm005667010
data_agm005667010
_cell_length_a 4.83590
_cell_length_b 6.07991
_cell_length_c 5.96720
_cell_angle_alpha 74.45951
_cell_angle_beta 66.09590
_cell_angle_gamma 66.56581
_cell_volume 145.97079
_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 0.54570 0.20078 0.70783 1.00000
Ca2 Ca 0.45478 0.79469 0.29574 1.00000
Cd1 Cd 0.16451 0.38969 0.28130 1.00000
Ag1 Ag 0.83521 0.61230 0.71727 1.00000
Ag2 Ag 0.83746 0.20738 0.11770 1.00000
Ag3 Ag 0.16234 0.79517 0.88015 1.00000
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