Na2V3Sn(PO4)6
Alexandria ALEXAlex-ID: agm010961550 · Space group: R3 (#146)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6E24_15_spg146
NaSn2(PO4)3 NaV2(PO4)3
2024-11-08 08:48:49.861572
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010961550).
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 agm010961550
data_agm010961550
_cell_length_a 8.84945
_cell_length_b 8.84945
_cell_length_c 8.84945
_cell_angle_alpha 58.19251
_cell_angle_beta 58.19251
_cell_angle_gamma 58.19251
_cell_volume 469.74537
_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 0.00289 0.00289 0.00289 1.00000
Na2 Na 0.49873 0.49873 0.49873 1.00000
V1 V 0.14542 0.14542 0.14542 1.00000
V2 V 0.35472 0.35472 0.35472 1.00000
V3 V 0.64452 0.64452 0.64452 1.00000
Sn1 Sn 0.85516 0.85516 0.85516 1.00000
P1 P 0.45806 0.74858 0.04015 1.00000
P2 P 0.74858 0.04015 0.45806 1.00000
P3 P 0.04015 0.45806 0.74858 1.00000
P4 P 0.96210 0.53441 0.25515 1.00000
P5 P 0.25515 0.96210 0.53441 1.00000
P6 P 0.53441 0.25515 0.96210 1.00000
O1 O 0.49777 0.30497 0.12308 1.00000
O2 O 0.12308 0.49777 0.30497 1.00000
O3 O 0.28343 0.93185 0.04988 1.00000
O4 O 0.30497 0.12308 0.49777 1.00000
O5 O 0.63186 0.76249 0.02604 1.00000
O6 O 0.41483 0.58598 0.22876 1.00000
O7 O 0.93185 0.04988 0.28343 1.00000
O8 O 0.58598 0.22876 0.41483 1.00000
O9 O 0.99070 0.36730 0.21787 1.00000
O10 O 0.22876 0.41483 0.58598 1.00000
O11 O 0.95620 0.71588 0.07665 1.00000
O12 O 0.21787 0.99070 0.36730 1.00000
O13 O 0.76249 0.02604 0.63186 1.00000
O14 O 0.04988 0.28343 0.93185 1.00000
O15 O 0.77280 0.56648 0.42067 1.00000
O16 O 0.02604 0.63186 0.76249 1.00000
O17 O 0.42067 0.77280 0.56648 1.00000
O18 O 0.07665 0.95620 0.71588 1.00000
O19 O 0.56648 0.42067 0.77280 1.00000
O20 O 0.36730 0.21787 0.99070 1.00000
O21 O 0.71006 0.87063 0.49400 1.00000
O22 O 0.71588 0.07665 0.95620 1.00000
O23 O 0.87063 0.49400 0.71006 1.00000
O24 O 0.49400 0.71006 0.87063 1.00000
