MgAg4Ge2Se7
Alexandria ALEXAlex-ID: agm020116484 · Space group: Cc (#9)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4D7_12_spg9
MgAg2GeSe4 GeSe2 Ag8GeSe6
2025-03-05 07:03:16
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020116484).
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 agm020116484
data_agm020116484
_cell_length_a 10.00217
_cell_length_b 10.00217
_cell_length_c 11.05546
_cell_angle_alpha 86.91319
_cell_angle_beta 93.08681
_cell_angle_gamma 137.77658
_cell_volume 742.03605
_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 0.02974 0.32693 0.29100 1.00000
Mg2 Mg 0.67307 0.97026 0.79100 1.00000
Ag1 Ag 0.17257 0.17438 0.99601 1.00000
Ag2 Ag 0.82562 0.82743 0.49601 1.00000
Ag3 Ag 0.39198 0.27536 0.37570 1.00000
Ag4 Ag 0.72464 0.60802 0.87570 1.00000
Ag5 Ag 0.53197 0.10422 0.10529 1.00000
Ag6 Ag 0.89578 0.46803 0.60529 1.00000
Ag7 Ag 0.40539 0.84596 0.44895 1.00000
Ag8 Ag 0.15404 0.59461 0.94895 1.00000
Ge1 Ge 0.60346 0.74802 0.16702 1.00000
Ge2 Ge 0.25198 0.39654 0.66702 1.00000
Ge3 Ge 0.96851 0.68849 0.24432 1.00000
Ge4 Ge 0.31151 0.03149 0.74432 1.00000
Se1 Se 0.20214 0.13561 0.58938 1.00000
Se2 Se 0.86439 0.79786 0.08938 1.00000
Se3 Se 0.31001 0.97510 0.29164 1.00000
Se4 Se 0.02490 0.68999 0.79164 1.00000
Se5 Se 0.91912 0.44546 0.14334 1.00000
Se6 Se 0.55454 0.08088 0.64334 1.00000
Se7 Se 0.53757 0.87066 0.00987 1.00000
Se8 Se 0.12934 0.46243 0.50987 1.00000
Se9 Se 0.71613 0.94506 0.34208 1.00000
Se10 Se 0.05494 0.28387 0.84208 1.00000
Se11 Se 0.60339 0.68961 0.69885 1.00000
Se12 Se 0.31039 0.39661 0.19885 1.00000
Se13 Se 0.77932 0.55097 0.42224 1.00000
Se14 Se 0.44903 0.22068 0.92224 1.00000
