U2H7I
Alexandria ALEXAlex-ID: agm006205683 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_759_spg12
H9I U4H15 U(HI)2
2024-02-01 10:10:00
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006205683).
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 agm006205683
data_agm006205683
_cell_length_a 3.55240
_cell_length_b 7.33375
_cell_length_c 6.04889
_cell_angle_alpha 124.06884
_cell_angle_beta 89.98088
_cell_angle_gamma 118.95821
_cell_volume 105.94177
_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
H1 H 0.26245 0.89493 0.40023 1.00000
H2 H 0.31351 0.44592 0.37655 1.00000
H3 H 0.41776 0.55056 0.74020 1.00000
H4 H 0.81707 0.94957 0.93293 1.00000
H5 H 0.70424 0.83664 0.51552 1.00000
H6 H 0.67408 0.30668 0.43311 1.00000
H7 H 0.28206 0.91440 0.09472 1.00000
U1 U 0.09018 0.72256 0.63844 1.00000
U2 U 0.96631 0.09881 0.39179 1.00000
I1 I 0.70472 0.33731 0.94467 1.00000
Get direct link