Na2Y3TmTe6
Alexandria ALEXAlex-ID: agm004629014 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_175_spg12
NaYTe2 NaTmTe2 YTe
2022-06-27 23:03:28.371106
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004629014).
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 agm004629014
data_agm004629014
_cell_length_a 7.58331
_cell_length_b 7.58331
_cell_length_c 7.69027
_cell_angle_alpha 99.43733
_cell_angle_beta 99.43733
_cell_angle_gamma 119.93687
_cell_volume 362.08463
_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
Na1 Na 0.33467 0.66533 0.00000 1.00000
Na2 Na 0.66533 0.33467 0.00000 1.00000
Y1 Y 0.17014 0.82986 0.50000 1.00000
Y2 Y 0.82986 0.17014 0.50000 1.00000
Y3 Y 0.50000 0.50000 0.50000 1.00000
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Te1 Te 0.91692 0.58955 0.75020 1.00000
Te2 Te 0.75870 0.75870 0.25431 1.00000
Te3 Te 0.08308 0.41045 0.24980 1.00000
Te4 Te 0.58955 0.91692 0.75020 1.00000
Te5 Te 0.24130 0.24130 0.74569 1.00000
Te6 Te 0.41045 0.08308 0.24980 1.00000
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