La2Nd(BiN)2
Alexandria ALEXAlex-ID: agm017697223 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_13_spg12
La2BiN NdN Bi
2025-06-25 02:41:04
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017697223).
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 agm017697223
data_agm017697223
_cell_length_a 3.95107
_cell_length_b 7.05626
_cell_length_c 8.33297
_cell_angle_alpha 60.72793
_cell_angle_beta 76.27701
_cell_angle_gamma 73.81074
_cell_volume 193.20258
_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
La1 La 0.78454 0.64038 0.79155 1.00000
La2 La 0.21546 0.35962 0.20845 1.00000
Nd1 Nd 0.00000 0.00000 0.00000 1.00000
Bi1 Bi 0.43467 0.74928 0.38537 1.00000
Bi2 Bi 0.56533 0.25072 0.61463 1.00000
N1 N 0.81308 0.30421 0.06857 1.00000
N2 N 0.18692 0.69579 0.93142 1.00000
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