Nd6Ga14Ru11
Alexandria ALEXAlex-ID: agm009448229 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A6B11C14_0_spg8
Nd8Ga21Ru11 NdGaRu Ru
2024-07-09 15:28:28.572998
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009448229).
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 agm009448229
data_agm009448229
_cell_length_a 11.01883
_cell_length_b 11.01883
_cell_length_c 14.46359
_cell_angle_alpha 59.13252
_cell_angle_beta 59.13252
_cell_angle_gamma 22.35977
_cell_volume 569.41357
_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
Nd1 Nd 0.62843 0.62843 0.68407 1.00000
Nd2 Nd 0.37157 0.37157 0.31593 1.00000
Nd3 Nd 0.12042 0.12042 0.14227 1.00000
Nd4 Nd 0.87958 0.87958 0.85773 1.00000
Nd5 Nd 0.15015 0.15015 0.85772 1.00000
Nd6 Nd 0.84985 0.84985 0.14228 1.00000
Ga1 Ga 0.60371 0.60371 0.48469 1.00000
Ga2 Ga 0.39629 0.39629 0.51531 1.00000
Ga3 Ga 0.22454 0.22454 0.28584 1.00000
Ga4 Ga 0.47602 0.47602 0.68959 1.00000
Ga5 Ga 0.45464 0.45464 0.94349 1.00000
Ga6 Ga 0.93165 0.93165 0.59936 1.00000
Ga7 Ga 0.54536 0.54536 0.05651 1.00000
Ga8 Ga 0.52398 0.52398 0.31041 1.00000
Ga9 Ga 0.19597 0.19597 0.49732 1.00000
Ga10 Ga 0.77546 0.77546 0.71416 1.00000
Ga11 Ga 0.26626 0.26626 0.92343 1.00000
Ga12 Ga 0.06835 0.06835 0.40064 1.00000
Ga13 Ga 0.80403 0.80403 0.50268 1.00000
Ga14 Ga 0.73374 0.73374 0.07657 1.00000
Ru1 Ru 0.70239 0.70239 0.92855 1.00000
Ru2 Ru 0.34505 0.34505 0.71947 1.00000
Ru3 Ru 0.05318 0.05318 0.60261 1.00000
Ru4 Ru 0.74374 0.74374 0.38447 1.00000
Ru5 Ru 0.02012 0.02012 0.80606 1.00000
Ru6 Ru 0.29761 0.29761 0.07145 1.00000
Ru7 Ru 0.94682 0.94682 0.39739 1.00000
Ru8 Ru 0.97988 0.97988 0.19394 1.00000
Ru9 Ru 0.25626 0.25626 0.61553 1.00000
Ru10 Ru 0.00000 0.00000 0.00000 1.00000
Ru11 Ru 0.65495 0.65495 0.28053 1.00000
