DyCr5C4
Alexandria ALEXAlex-ID: agm006124147 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_20_spg71
Cr3C2 Cr7C3 Dy2Cr2C3
2023-10-10 19:06:44
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006124147).
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 agm006124147
data_agm006124147
_cell_length_a 3.10786
_cell_length_b 5.85198
_cell_length_c 6.79368
_cell_angle_alpha 115.51153
_cell_angle_beta 103.22240
_cell_angle_gamma 90.00000
_cell_volume 107.86951
_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
Dy1 Dy 0.50000 0.00000 0.00000 1.00000
Cr1 Cr 0.82847 0.06690 0.65695 1.00000
Cr2 Cr 0.82847 0.59005 0.65695 1.00000
Cr3 Cr 0.17153 0.40995 0.34305 1.00000
Cr4 Cr 0.17153 0.93310 0.34305 1.00000
Cr5 Cr 0.50000 0.50000 0.00000 1.00000
C1 C 0.00000 0.70859 0.00000 1.00000
C2 C 0.29072 0.79072 0.58144 1.00000
C3 C 0.70928 0.20928 0.41856 1.00000
C4 C 1.00000 0.29141 1.00000 1.00000
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