
#(C) 2026 by FIZ Karlsruhe - Leibniz Institute for Information Infrastructure.  All rights reserved.
data_257440-ICSD
_database_code_ICSD 257440
_audit_creation_date 2018-02-01
_chemical_name_common 'Lithium phosphate - gamma phase'
_chemical_formula_structural 'Li3 P O4'
_chemical_formula_sum 'Li3 O4 P1'
_chemical_name_structure_type Li3PO4
_exptl_crystal_density_diffrn 2.43
_citation_title

;
Crystal structure analysis of Li3PO4 powder prepared by wet chemical reaction
and solid-state reaction by using X-ray diffraction (XRD)
;
loop_
_citation_id
_citation_journal_full
_citation_year
_citation_journal_volume
_citation_page_first
_citation_page_last
_citation_journal_id_ASTM
primary Ionics 2016 22 1051 1057 IONIFA
loop_
_citation_author_citation_id
_citation_author_name
primary 'Ayu, Nur I.P.'
primary 'Kartini, Evvy'
primary 'Prayogi, Lugas D.'
primary 'Faisal, Muhamad'
primary Supardi
_cell_length_a 6.1149(0)
_cell_length_b 10.4728(2)
_cell_length_c 4.9238(0)
_cell_angle_alpha 90.
_cell_angle_beta 90.
_cell_angle_gamma 90.
_cell_volume 315.32
_cell_formula_units_Z 4
_space_group_name_H-M_alt 'P m n b'
_space_group_IT_number 62
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y+1/2, -z+1/2'
2 '-x+1/2, y, z'
3 'x+1/2, -y+1/2, z+1/2'
4 '-x, -y, -z'
5 '-x, -y+1/2, z+1/2'
6 'x+1/2, -y, -z'
7 '-x+1/2, y+1/2, -z+1/2'
8 'x, y, z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
Li1+ 1
P5+ 5
O2- -2
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_occupancy
Li1 Li1+ 8 d 0.5004(10) 0.1653(6) 0.3107(15) 0.0192(25) 1.
Li2 Li1+ 4 c 0.75 0.4175(9) 0.2106(23) 0.0330(38) 1.
P1 P5+ 4 c 0.25 0.4104(1) 0.3086(3) 0.0126(8) 1.
O1 O2- 8 d 0.0400(3) 0.3389(2) 0.2043(5) 0.0133(11) 1.
O2 O2- 4 c 0.25 0.0531(3) 0.2960(7) 0.0067(12) 1.
O3 O2- 4 c 0.75 0.0908(3) 0.1273(6) 0.0049(13) 1.
#End of TTdata_257440-ICSD