Sr2VCrH8
Alexandria ALEXAlex-ID: agm007266554 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_318_spg2
Sr2CrH6 SrVH5 Cr
2024-03-16 06:56:53.342174
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007266554).
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 agm007266554
data_agm007266554
_cell_length_a 5.28601
_cell_length_b 4.90786
_cell_length_c 5.83097
_cell_angle_alpha 114.91766
_cell_angle_beta 90.41954
_cell_angle_gamma 90.32658
_cell_volume 137.18159
_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
Sr1 Sr 0.23994 0.66915 0.33738 1.00000
Sr2 Sr 0.76006 0.33085 0.66262 1.00000
V1 V 0.50000 0.00000 0.00000 1.00000
Cr1 Cr 0.00000 0.00000 0.00000 1.00000
H1 H 0.95297 0.83975 0.67774 1.00000
H2 H 0.76521 0.27637 0.06558 1.00000
H3 H 0.76210 0.78865 0.06445 1.00000
H4 H 0.04703 0.16025 0.32226 1.00000
H5 H 0.23479 0.72363 0.93442 1.00000
H6 H 0.23790 0.21135 0.93555 1.00000
H7 H 0.46196 0.16674 0.33620 1.00000
H8 H 0.53804 0.83326 0.66380 1.00000
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