PmAgMoO5
Alexandria ALEXAlex-ID: agm005065249 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD5_35_spg9
Ag2O Pm6MoO12 Pm2(MoO4)3
2022-07-13 03:02:45.298912
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005065249).
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 agm005065249
data_agm005065249
_cell_length_a 6.40950
_cell_length_b 6.40950
_cell_length_c 8.70727
_cell_angle_alpha 109.82607
_cell_angle_beta 109.82607
_cell_angle_gamma 92.00888
_cell_volume 311.97524
_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
Pm1 Pm 0.00000 0.00000 0.50000 1.00000
Pm2 Pm 0.00000 0.00000 0.00000 1.00000
Ag1 Ag 0.29970 0.70030 0.25000 1.00000
Ag2 Ag 0.70030 0.29970 0.75000 1.00000
Mo1 Mo 0.63499 0.36501 0.25000 1.00000
Mo2 Mo 0.36501 0.63499 0.75000 1.00000
O1 O 0.07047 0.92953 0.25000 1.00000
O2 O 0.92953 0.07047 0.75000 1.00000
O3 O 0.75307 0.25503 0.08592 1.00000
O4 O 0.24693 0.74497 0.91408 1.00000
O5 O 0.74497 0.24693 0.41408 1.00000
O6 O 0.25503 0.75307 0.58592 1.00000
O7 O 0.70998 0.66883 0.34852 1.00000
O8 O 0.29002 0.33117 0.65148 1.00000
O9 O 0.33117 0.29002 0.15148 1.00000
O10 O 0.66883 0.70998 0.84852 1.00000
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