Sr3C2
Alexandria ALEXAlex-ID: agm005505385 · Space group: Fdd2 (#43)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_527_spg43
SrC6 Sr
2023-03-19 17:13:15.800597
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005505385).
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 agm005505385
data_agm005505385
_cell_length_a 8.35594
_cell_length_b 7.28049
_cell_length_c 7.12036
_cell_angle_alpha 70.92483
_cell_angle_beta 55.43194
_cell_angle_gamma 53.64324
_cell_volume 287.23162
_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 0.62118 0.80171 0.21489 1.00000
Sr2 Sr 0.36222 0.21489 0.80171 1.00000
Sr3 Sr 0.03511 0.88778 0.62882 1.00000
Sr4 Sr 0.44829 0.62882 0.88778 1.00000
Sr5 Sr 0.16281 0.33719 0.33719 1.00000
Sr6 Sr 0.91281 0.08719 0.08719 1.00000
C1 C 0.60913 0.18047 0.96574 1.00000
C2 C 0.24466 0.96574 0.18047 1.00000
C3 C 0.28426 0.00534 0.64087 1.00000
C4 C 0.06953 0.64087 0.00534 1.00000
Get direct link