SrTc
Alexandria ALEXAlex-ID: agm005453985 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB_1536_spg8
Tc Sr
2023-03-22 00:31:07.107935
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005453985).
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 agm005453985
data_agm005453985
_cell_length_a 6.86002
_cell_length_b 6.86002
_cell_length_c 7.63139
_cell_angle_alpha 67.34672
_cell_angle_beta 67.34672
_cell_angle_gamma 31.84816
_cell_volume 173.63936
_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 0.92135 0.92135 0.07527 1.00000
Sr2 Sr 0.65536 0.65536 0.67300 1.00000
Sr3 Sr 0.63379 0.63379 0.21645 1.00000
Tc1 Tc 0.37212 0.37212 0.45358 1.00000
Tc2 Tc 0.92586 0.92586 0.60100 1.00000
Tc3 Tc 0.32486 0.32486 0.81403 1.00000
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