Ce2Ga2Mo2C
Alexandria ALEXAlex-ID: agm024121968 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_13_spg12
Ce3Ga5 Ce2Mo2C3 Mo CeGa
2025-02-04 09:50:53
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024121968).
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 agm024121968
data_agm024121968
_cell_length_a 6.01735
_cell_length_b 6.01735
_cell_length_c 7.54675
_cell_angle_alpha 57.94667
_cell_angle_beta 122.05333
_cell_angle_gamma 143.86389
_cell_volume 133.69555
_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
Ce1 Ce 0.57452 0.42548 0.78568 1.00000
Ce2 Ce 0.42548 0.57452 0.21432 1.00000
Ga1 Ga 0.13003 0.86997 0.15769 1.00000
Ga2 Ga 0.86997 0.13003 0.84231 1.00000
Mo1 Mo 0.19989 0.80011 0.56925 1.00000
Mo2 Mo 0.80011 0.19989 0.43075 1.00000
C1 C 0.00000 0.00000 0.50000 1.00000
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