Li3Mn2(SiO4)2
Alexandria ALEXAlex-ID: agm005268174 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3D8_3_spg1
Mn7SiO12 Li2MnSiO4 Li2Si2O5 Li2SiO3
2023-05-06 22:05:48.717402
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005268174).
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 agm005268174
data_agm005268174
_cell_length_a 4.89609
_cell_length_b 5.42955
_cell_length_c 6.68969
_cell_angle_alpha 88.44561
_cell_angle_beta 89.64066
_cell_angle_gamma 88.71388
_cell_volume 177.72258
_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
Li1 Li 0.50129 0.18556 0.00518 1.00000
Li2 Li 0.00280 0.81196 0.49641 1.00000
Li3 Li 0.00845 0.34326 0.24165 1.00000
Mn1 Mn 0.00468 0.82292 0.97626 1.00000
Mn2 Mn 0.51625 0.16632 0.50755 1.00000
Si1 Si 0.98790 0.32877 0.75105 1.00000
Si2 Si 0.49604 0.67639 0.24258 1.00000
O1 O 0.09962 0.19446 0.96207 1.00000
O2 O 0.65489 0.29160 0.75347 1.00000
O3 O 0.06438 0.61861 0.73730 1.00000
O4 O 0.10183 0.18244 0.54685 1.00000
O5 O 0.60339 0.82794 0.43397 1.00000
O6 O 0.15775 0.68157 0.24134 1.00000
O7 O 0.60279 0.38414 0.25442 1.00000
O8 O 0.60149 0.82213 0.03757 1.00000
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