RbScGe
Alexandria ALEXAlex-ID: agm003141925 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_2266_spg8
ScGe Rb
2015-06-15 08:41:59
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003141925).
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
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# CIF generated by HEAS from Alexandria entry agm003141925
data_agm003141925
_cell_length_a 15.37283
_cell_length_b 6.44223
_cell_length_c 6.44223
_cell_angle_alpha 143.38349
_cell_angle_beta 143.13345
_cell_angle_gamma 36.86655
_cell_volume 204.88333
_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
Sc1 Sc 0.52775 0.63761 0.36239 1.00000
Sc2 Sc 0.61502 0.82047 0.17953 1.00000
Ge1 Ge 0.79180 0.23043 0.76957 1.00000
Ge2 Ge 0.48094 0.33225 0.66775 1.00000
Rb1 Rb 0.92811 0.80102 0.19898 1.00000
Rb2 Rb 0.16403 0.29159 0.70841 1.00000
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