Nd6GeTe3Pb2
Alexandria ALEXAlex-ID: agm004595415 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_28_spg12
Nd2TePb Nd3GeTe2 NdPb
2022-06-27 11:52:55.870454
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004595415).
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 agm004595415
data_agm004595415
_cell_length_a 4.48323
_cell_length_b 9.07016
_cell_length_c 10.09364
_cell_angle_alpha 103.18881
_cell_angle_beta 102.83133
_cell_angle_gamma 90.00000
_cell_volume 389.08312
_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 0.34173 0.91889 0.68345 1.00000
Nd2 Nd 0.66683 0.58062 0.33367 1.00000
Nd3 Nd 0.65827 0.08111 0.31655 1.00000
Nd4 Nd 0.00037 0.22968 0.00074 1.00000
Nd5 Nd 0.99963 0.77032 0.99926 1.00000
Nd6 Nd 0.33317 0.41938 0.66633 1.00000
Ge1 Ge 0.50000 0.00000 0.00000 1.00000
Te1 Te 0.50000 0.50000 0.00000 1.00000
Te2 Te 0.83161 0.16545 0.66322 1.00000
Te3 Te 0.16839 0.83455 0.33678 1.00000
Pb1 Pb 0.83357 0.66737 0.66713 1.00000
Pb2 Pb 0.16643 0.33263 0.33287 1.00000
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