Nd3(TmPb2)2
Alexandria ALEXAlex-ID: agm005691334 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_899_spg2
Nd2Tm3Pb4 Nd5Pb4
2023-06-27 12:09:34.840737
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005691334).
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 agm005691334
data_agm005691334
_cell_length_a 5.11483
_cell_length_b 6.93873
_cell_length_c 8.60040
_cell_angle_alpha 104.80862
_cell_angle_beta 107.29904
_cell_angle_gamma 90.00007
_cell_volume 280.78839
_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 0.12010 0.58272 0.24020 1.00000
Nd2 Nd 0.87990 0.41728 0.75980 1.00000
Nd3 Nd 0.00000 0.00000 0.00000 1.00000
Tm1 Tm 0.66665 0.07111 0.33329 1.00000
Tm2 Tm 0.33335 0.92889 0.66671 1.00000
Pb1 Pb 0.49286 0.71565 0.98572 1.00000
Pb2 Pb 0.24087 0.27448 0.48174 1.00000
Pb3 Pb 0.50714 0.28435 0.01428 1.00000
Pb4 Pb 0.75913 0.72552 0.51826 1.00000
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