NdTlGe
Alexandria ALEXAlex-ID: agm005692164 · Space group: R3m (#160)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_2367_spg8
Nd2TlGe2 Tl
2023-06-20 14:38:53.249990
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005692164).
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 agm005692164
data_agm005692164
_cell_length_a 10.77660
_cell_length_b 10.77660
_cell_length_c 10.77660
_cell_angle_alpha 23.09892
_cell_angle_beta 23.09892
_cell_angle_gamma 23.09892
_cell_volume 169.08143
_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 0.24459 0.24459 0.24459 1.00000
Nd2 Nd 0.11849 0.11849 0.11849 1.00000
Tl1 Tl 0.37853 0.37853 0.37853 1.00000
Tl2 Tl 0.65125 0.65125 0.65125 1.00000
Ge1 Ge 0.84567 0.84567 0.84567 1.00000
Ge2 Ge 0.51791 0.51791 0.51791 1.00000
