Mg3Tc2
Alexandria ALEXAlex-ID: agm005408055 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_86_spg69
MgTc Mg
2023-03-17 17:22:25.496380
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005408055).
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 agm005408055
data_agm005408055
_cell_length_a 11.84811
_cell_length_b 11.74878
_cell_length_c 2.75917
_cell_angle_alpha 85.33828
_cell_angle_beta 81.24049
_cell_angle_gamma 13.42123
_cell_volume 84.28347
_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
Mg1 Mg 0.80762 0.80762 0.19238 1.00000
Mg2 Mg 0.19238 0.19238 0.80762 1.00000
Mg3 Mg 0.00000 0.00000 0.00000 1.00000
Tc1 Tc 0.59736 0.59736 0.40264 1.00000
Tc2 Tc 0.40264 0.40264 0.59736 1.00000
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