Pr3TlCd2Ag3
Alexandria ALEXAlex-ID: agm033353864 · Space group: Amm2 (#38)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D3_0_spg189
PrCdAg PrAg2 Pr14Ag51 Pr3Tl5
2024-11-01 11:50:02.672661
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033353864).
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 agm033353864
data_agm033353864
_cell_length_a 8.10916
_cell_length_b 8.10916
_cell_length_c 4.02605
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 119.44393
_cell_volume 230.55150
_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
Pr1 Pr 0.59869 0.59869 0.50000 1.00000
Pr2 Pr 0.40500 0.99971 0.50000 1.00000
Pr3 Pr 0.99971 0.40500 0.50000 1.00000
Tl1 Tl 0.26217 0.26217 0.00000 1.00000
Cd1 Cd 0.73651 0.99967 0.00000 1.00000
Cd2 Cd 0.99967 0.73651 0.00000 1.00000
Ag1 Ag 0.33418 0.67136 0.00000 1.00000
Ag2 Ag 0.67136 0.33418 0.00000 1.00000
Ag3 Ag 0.99262 0.99262 0.50000 1.00000
Get direct link