Ba8NaAg2Pt
Alexandria ALEXAlex-ID: agm004909151 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_356_spg65
Ba2NaAg2 Ba6Pt
2023-01-01 22:23:03.382172
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004909151).
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 agm004909151
data_agm004909151
_cell_length_a 8.10657
_cell_length_b 7.82258
_cell_length_c 9.98868
_cell_angle_alpha 89.85012
_cell_angle_beta 89.93209
_cell_angle_gamma 89.01671
_cell_volume 633.32877
_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
Ba1 Ba 0.16383 0.75500 0.21754 1.00000
Ba2 Ba 0.68335 0.75774 0.99953 1.00000
Ba3 Ba 0.83479 0.24392 0.21699 1.00000
Ba4 Ba 0.83617 0.24500 0.78246 1.00000
Ba5 Ba 0.31665 0.24226 0.00047 1.00000
Ba6 Ba 0.16521 0.75608 0.78301 1.00000
Ba7 Ba 0.63551 0.73080 0.49925 1.00000
Ba8 Ba 0.36449 0.26920 0.50075 1.00000
Na1 Na 0.00000 0.00000 0.50000 1.00000
Ag1 Ag 0.50030 0.50005 0.76374 1.00000
Ag2 Ag 0.49970 0.49995 0.23626 1.00000
Pt1 Pt 0.00000 0.00000 0.00000 1.00000
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