DyMgB14
Alexandria ALEXAlex-ID: agm005754727 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC14_1_spg74
DyB12 MgB7 DyB4
2023-07-18 13:54:40.570680
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005754727).
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 agm005754727
data_agm005754727
_cell_length_a 5.93221
_cell_length_b 7.35934
_cell_length_c 7.35934
_cell_angle_alpha 68.22224
_cell_angle_beta 66.23166
_cell_angle_gamma 66.23167
_cell_volume 260.62075
_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 0.25000 0.39121 0.10879 1.00000
Dy2 Dy 0.75000 0.60879 0.89121 1.00000
Mg1 Mg 0.50000 0.00000 0.50000 1.00000
Mg2 Mg 0.00000 0.00000 0.50000 1.00000
B1 B 0.66673 0.36372 0.30282 1.00000
B2 B 0.33327 0.63628 0.69718 1.00000
B3 B 0.16673 0.80282 0.86372 1.00000
B4 B 0.83327 0.19718 0.13628 1.00000
B5 B 0.13560 0.23990 0.48891 1.00000
B6 B 0.86440 0.76010 0.51109 1.00000
B7 B 0.63560 0.98891 0.73990 1.00000
B8 B 0.36440 0.01109 0.26010 1.00000
B9 B 0.08395 0.08651 0.74558 1.00000
B10 B 0.91605 0.91349 0.25442 1.00000
B11 B 0.58395 0.24558 0.58651 1.00000
B12 B 0.41605 0.75442 0.41349 1.00000
B13 B 0.72074 0.60013 0.27767 1.00000
B14 B 0.59854 0.39987 0.72233 1.00000
B15 B 0.22074 0.77767 0.10013 1.00000
B16 B 0.09854 0.22233 0.89987 1.00000
B17 B 0.27926 0.39987 0.72233 1.00000
B18 B 0.40146 0.60013 0.27767 1.00000
B19 B 0.77926 0.22233 0.89987 1.00000
B20 B 0.90146 0.77767 0.10013 1.00000
B21 B 0.32493 0.96930 0.87666 1.00000
B22 B 0.17088 0.03070 0.12334 1.00000
B23 B 0.82493 0.37666 0.46930 1.00000
B24 B 0.67088 0.62334 0.53070 1.00000
B25 B 0.67507 0.03070 0.12334 1.00000
B26 B 0.82912 0.96930 0.87666 1.00000
B27 B 0.17507 0.62334 0.53070 1.00000
B28 B 0.32912 0.37666 0.46930 1.00000
