Dy6In2C
Alexandria ALEXAlex-ID: agm005779700 · Space group: Fm-3m (#225)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_1731_spg139
Dy9In3C2 Dy2In Dy
2023-07-12 08:23:40.778197
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005779700).
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 agm005779700
data_agm005779700
_cell_length_a 6.92936
_cell_length_b 6.92936
_cell_length_c 6.92939
_cell_angle_alpha 60.00035
_cell_angle_beta 60.00035
_cell_angle_gamma 60.00006
_cell_volume 235.27116
_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 0.25474 0.25474 0.74486 1.00000
Dy2 Dy 0.25493 0.74546 0.25455 1.00000
Dy3 Dy 0.74507 0.25454 0.74545 1.00000
Dy4 Dy 0.74546 0.25493 0.25455 1.00000
Dy5 Dy 0.25454 0.74507 0.74545 1.00000
Dy6 Dy 0.74526 0.74526 0.25514 1.00000
In1 In 0.25000 0.25000 0.24994 1.00000
In2 In 0.75000 0.75000 0.75006 1.00000
C1 C 0.50000 0.50000 0.50000 1.00000
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