Li(NdCd)2
Alexandria ALEXAlex-ID: agm005881069 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_1499_spg15
Li3Cd NdCd Nd
2023-08-03 21:36:22.802745
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005881069).
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 agm005881069
data_agm005881069
_cell_length_a 6.44235
_cell_length_b 9.20512
_cell_length_c 12.81152
_cell_angle_alpha 22.96423
_cell_angle_beta 75.43795
_cell_angle_gamma 69.51676
_cell_volume 272.42660
_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
Li1 Li 0.18480 0.75000 0.25000 1.00000
Li2 Li 0.81520 0.25000 0.75000 1.00000
Nd1 Nd 0.48460 0.82651 0.92194 1.00000
Nd2 Nd 0.76696 0.32651 0.42194 1.00000
Nd3 Nd 0.51540 0.17349 0.07806 1.00000
Nd4 Nd 0.23304 0.67349 0.57806 1.00000
Cd1 Cd 0.30136 0.13596 0.50193 1.00000
Cd2 Cd 0.93925 0.36404 0.99807 1.00000
Cd3 Cd 0.69864 0.86404 0.49807 1.00000
Cd4 Cd 0.06075 0.63596 0.00193 1.00000
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