Te4Pd3
Alexandria ALEXAlex-ID: agm002179556 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4_0_spg12
Te2Pd Te2Pd3
2018-05-31 10:49:52
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002179556).
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
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# CIF generated by HEAS from Alexandria entry agm002179556
data_agm002179556
_cell_length_a 4.22538
_cell_length_b 6.90790
_cell_length_c 7.04286
_cell_angle_alpha 119.79920
_cell_angle_beta 90.03817
_cell_angle_gamma 107.79606
_cell_volume 166.93263
_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
Te1 Te 0.88602 0.77185 0.53918 1.00000
Te2 Te 0.11398 0.22815 0.46082 1.00000
Te3 Te 0.63616 0.27306 0.98283 1.00000
Te4 Te 0.36384 0.72694 0.01717 1.00000
Pd1 Pd 0.73802 0.47624 0.72200 1.00000
Pd2 Pd 0.26198 0.52376 0.27800 1.00000
Pd3 Pd 0.00000 0.00000 0.00000 1.00000
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