YAg(NO3)2
Alexandria ALEXAlex-ID: agm004944481 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_484_spg15
Y(NO3)3 Y2O3 N2 Ag
2022-07-27 22:47:12.741258
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004944481).
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 agm004944481
data_agm004944481
_cell_length_a 6.23552
_cell_length_b 6.23552
_cell_length_c 7.32814
_cell_angle_alpha 98.14852
_cell_angle_beta 98.14852
_cell_angle_gamma 107.65127
_cell_volume 263.57128
_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
Y1 Y 0.57285 0.42715 0.25000 1.00000
Y2 Y 0.42715 0.57285 0.75000 1.00000
Ag1 Ag 0.10441 0.89559 0.25000 1.00000
Ag2 Ag 0.89559 0.10441 0.75000 1.00000
N1 N 0.40080 0.11586 0.80747 1.00000
N2 N 0.88414 0.59920 0.69253 1.00000
N3 N 0.59920 0.88414 0.19253 1.00000
N4 N 0.11586 0.40080 0.30747 1.00000
O1 O 0.96595 0.50494 0.26536 1.00000
O2 O 0.49506 0.03405 0.23464 1.00000
O3 O 0.03405 0.49506 0.73464 1.00000
O4 O 0.50494 0.96595 0.76536 1.00000
O5 O 0.16051 0.27097 0.16386 1.00000
O6 O 0.72903 0.83949 0.33614 1.00000
O7 O 0.83949 0.72903 0.83614 1.00000
O8 O 0.27097 0.16051 0.66386 1.00000
O9 O 0.31518 0.54111 0.42161 1.00000
O10 O 0.45889 0.68482 0.07839 1.00000
O11 O 0.68482 0.45889 0.57839 1.00000
O12 O 0.54111 0.31518 0.92161 1.00000
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