TcGe2H7
Alexandria ALEXAlex-ID: agm006193643 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_757_spg1
TcGe GeH8 TcGe2
2024-01-01 03:00:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006193643).
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 agm006193643
data_agm006193643
_cell_length_a 4.98023
_cell_length_b 4.87159
_cell_length_c 6.36422
_cell_angle_alpha 115.58519
_cell_angle_beta 47.09518
_cell_angle_gamma 122.95578
_cell_volume 94.42501
_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
H1 H 0.94698 0.57826 0.25345 1.00000
H2 H 0.97314 0.05693 0.72803 1.00000
H3 H 0.41465 0.51158 0.74373 1.00000
H4 H 0.07635 0.20378 0.01034 1.00000
H5 H 0.58470 0.99999 0.55573 1.00000
H6 H 0.53514 0.15461 0.24942 1.00000
H7 H 0.98857 0.49048 0.69094 1.00000
Ge1 Ge 0.38955 0.97391 0.90565 1.00000
Ge2 Ge 0.40817 0.69204 0.35820 1.00000
Tc1 Tc 0.91515 0.39581 0.97267 1.00000
Get direct link