DyMg2Rh3
Alexandria ALEXAlex-ID: agm034349398 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_4629_spg15
DyMg2Rh3
2025-01-04 12:21:46
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm034349398).
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 agm034349398
data_agm034349398
_cell_length_a 7.20683
_cell_length_b 7.20683
_cell_length_c 7.91142
_cell_angle_alpha 89.97598
_cell_angle_beta 90.02402
_cell_angle_gamma 101.33856
_cell_volume 402.88609
_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 0.72002 0.54126 0.41880 1.00000
Dy2 Dy 0.27998 0.45874 0.58120 1.00000
Dy3 Dy 0.45874 0.27998 0.91880 1.00000
Dy4 Dy 0.54126 0.72002 0.08120 1.00000
Mg1 Mg 0.62808 0.12457 0.25024 1.00000
Mg2 Mg 0.20696 0.03687 0.41815 1.00000
Mg3 Mg 0.79304 0.96313 0.58185 1.00000
Mg4 Mg 0.37192 0.87543 0.74976 1.00000
Mg5 Mg 0.87543 0.37192 0.75024 1.00000
Mg6 Mg 0.96313 0.79304 0.91815 1.00000
Mg7 Mg 0.03687 0.20696 0.08185 1.00000
Mg8 Mg 0.12457 0.62808 0.24976 1.00000
Rh1 Rh 0.45762 0.80273 0.42078 1.00000
Rh2 Rh 0.95676 0.27990 0.40982 1.00000
Rh3 Rh 0.54238 0.19727 0.57922 1.00000
Rh4 Rh 0.04324 0.72010 0.59018 1.00000
Rh5 Rh 0.63316 0.63316 0.75000 1.00000
Rh6 Rh 0.11610 0.11610 0.75000 1.00000
Rh7 Rh 0.19727 0.54238 0.92078 1.00000
Rh8 Rh 0.72010 0.04324 0.90982 1.00000
Rh9 Rh 0.80273 0.45762 0.07922 1.00000
Rh10 Rh 0.27990 0.95676 0.09018 1.00000
Rh11 Rh 0.36684 0.36684 0.25000 1.00000
Rh12 Rh 0.88390 0.88390 0.25000 1.00000
