Pr5NdGe4
Alexandria ALEXAlex-ID: agm003655331 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_166_spg12
Pr4Ge3 Nd4Ge3 Pr
2022-04-06 13:56:54.128150
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003655331).
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 agm003655331
data_agm003655331
_cell_length_a 5.21226
_cell_length_b 7.10063
_cell_length_c 10.95854
_cell_angle_alpha 130.15627
_cell_angle_beta 103.75775
_cell_angle_gamma 90.00000
_cell_volume 294.59129
_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
Pr1 Pr 0.83478 0.67739 0.66956 1.00000
Pr2 Pr 0.83521 0.16279 0.67042 1.00000
Pr3 Pr 0.16479 0.83721 0.32958 1.00000
Pr4 Pr 0.50000 0.50000 0.00000 1.00000
Pr5 Pr 0.16522 0.32261 0.33044 1.00000
Nd1 Nd 0.50000 0.00000 0.00000 1.00000
Ge1 Ge 0.32254 0.89466 0.64507 1.00000
Ge2 Ge 0.99033 0.73254 0.98066 1.00000
Ge3 Ge 0.67746 0.10534 0.35493 1.00000
Ge4 Ge 0.00967 0.26746 0.01934 1.00000
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