La3ErCo2
Alexandria ALEXAlex-ID: agm005688970 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_986_spg12
La4Co La5Co2 ErCo
2023-08-17 09:34:29.077688
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005688970).
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 agm005688970
data_agm005688970
_cell_length_a 4.05495
_cell_length_b 8.62790
_cell_length_c 10.37613
_cell_angle_alpha 79.96318
_cell_angle_beta 78.73171
_cell_angle_gamma 76.40890
_cell_volume 342.89704
_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
La1 La 0.05852 0.07554 0.80742 1.00000
La2 La 0.94148 0.92446 0.19258 1.00000
La3 La 0.69364 0.67660 0.93612 1.00000
La4 La 0.30636 0.32340 0.06388 1.00000
La5 La 0.81942 0.80680 0.55436 1.00000
La6 La 0.18058 0.19320 0.44564 1.00000
Er1 Er 0.43941 0.42771 0.69347 1.00000
Er2 Er 0.56059 0.57229 0.30653 1.00000
Co1 Co 0.87386 0.37949 0.87279 1.00000
Co2 Co 0.12614 0.62051 0.12721 1.00000
Co3 Co 0.62442 0.12669 0.62447 1.00000
Co4 Co 0.37558 0.87331 0.37553 1.00000
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