Er3Ge7Pd4
Alexandria ALEXAlex-ID: agm008544404 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C7_18_spg12
Er3(GePd)4 Ge
2024-05-09 18:26:27.607405
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008544404).
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 agm008544404
data_agm008544404
_cell_length_a 8.30849
_cell_length_b 8.30849
_cell_length_c 9.86929
_cell_angle_alpha 52.58640
_cell_angle_beta 52.58640
_cell_angle_gamma 29.51378
_cell_volume 261.10892
_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
Er1 Er 0.67526 0.67526 0.81531 1.00000
Er2 Er 0.32474 0.32474 0.18469 1.00000
Er3 Er 0.00000 0.00000 0.50000 1.00000
Ge1 Ge 0.67493 0.67493 0.22419 1.00000
Ge2 Ge 0.47514 0.47514 0.80251 1.00000
Ge3 Ge 0.15637 0.15637 0.61759 1.00000
Ge4 Ge 0.32507 0.32507 0.77581 1.00000
Ge5 Ge 0.84363 0.84363 0.38241 1.00000
Ge6 Ge 0.00000 0.00000 0.00000 1.00000
Ge7 Ge 0.52486 0.52486 0.19749 1.00000
Pd1 Pd 0.35251 0.35251 0.50125 1.00000
Pd2 Pd 0.64749 0.64749 0.49875 1.00000
Pd3 Pd 0.15368 0.15368 0.08992 1.00000
Pd4 Pd 0.84632 0.84632 0.91008 1.00000
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