Ca4Cu(SnGe)2
Alexandria ALEXAlex-ID: agm004564708 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D4_90_spg12
Ca3CuSn3 Ca3CuGe3 CaSn
2022-06-19 10:48:11.302770
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004564708).
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 agm004564708
data_agm004564708
_cell_length_a 5.86452
_cell_length_b 6.74751
_cell_length_c 6.74751
_cell_angle_alpha 63.56310
_cell_angle_beta 78.34889
_cell_angle_gamma 78.34889
_cell_volume 232.23808
_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 0.25032 0.62234 0.12966 1.00000
Ca2 Ca 0.74968 0.87034 0.37766 1.00000
Ca3 Ca 0.74968 0.37766 0.87034 1.00000
Ca4 Ca 0.25032 0.12966 0.62234 1.00000
Cu1 Cu 0.50000 0.00000 0.00000 1.00000
Sn1 Sn 0.24429 0.62964 0.62964 1.00000
Sn2 Sn 0.75571 0.37036 0.37036 1.00000
Ge1 Ge 0.17343 0.15840 0.15840 1.00000
Ge2 Ge 0.82657 0.84160 0.84160 1.00000
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