
#(C) 2025 by FIZ Karlsruhe - Leibniz Institute for Information Infrastructure.  All rights reserved.
data_35405-ICSD
_database_code_ICSD 35405
_audit_creation_date 1983-12-31
_chemical_name_common 'Dirubidium 14-lithium 14-oxo-triplumbate'
_chemical_formula_structural 'Rb2 Li14 (Pb3 O14)'
_chemical_formula_sum 'Li14 O14 Pb3 Rb2'
_chemical_name_structure_type K2Li14Pb3O4
_exptl_crystal_density_diffrn 4.99
_citation_title 'Zur Kenntnis von Rb2 Li14 (Pb3 O14) und Cs2 Li14 (Pb3 O14)'
loop_
_citation_id
_citation_journal_full
_citation_year
_citation_journal_volume
_citation_page_first
_citation_page_last
_citation_journal_id_ASTM
primary 'Zeitschrift fuer Anorganische und Allgemeine Chemie (1950) (DE)' 1983
498 167 173 ZAACAB
loop_
_citation_author_citation_id
_citation_author_name
primary 'Brazel, B.'
primary 'Hoppe, R.'
_cell_length_a 12.8471(9)
_cell_length_b 7.9390(4)
_cell_length_c 7.2735(5)
_cell_angle_alpha 90.
_cell_angle_beta 90.
_cell_angle_gamma 90.
_cell_volume 741.85
_cell_formula_units_Z 2
_space_group_name_H-M_alt 'I m m m'
_space_group_IT_number 71
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, -z'
2 'x, -y, z'
3 '-x, y, z'
4 '-x, -y, -z'
5 '-x, -y, z'
6 '-x, y, -z'
7 'x, -y, -z'
8 'x, y, z'
9 'x+1/2, y+1/2, -z+1/2'
10 'x+1/2, -y+1/2, z+1/2'
11 '-x+1/2, y+1/2, z+1/2'
12 '-x+1/2, -y+1/2, -z+1/2'
13 '-x+1/2, -y+1/2, z+1/2'
14 '-x+1/2, y+1/2, -z+1/2'
15 'x+1/2, -y+1/2, -z+1/2'
16 'x+1/2, y+1/2, z+1/2'
loop_
_atom_type_symbol
_atom_type_oxidation_number
Pb4+ 4
Rb1+ 1
Li1+ 1
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
Pb1 Pb4+ 4 e 0.2723(1) 0 0 . 1.
Pb2 Pb4+ 2 a 0 0 0 . 1.
Rb1 Rb1+ 4 j 0.5 0 0.2679(3) . 1.
Li1 Li1+ 4 h 0 0.1567(46) 0.5 0.0095(57) 1.
Li2 Li1+ 8 n 0.2287(22) 0.3544(40) 0 0.0175(52) 1.
Li3 Li1+ 16 o 0.1369(14) 0.1579(26) 0.2718(28) 0.0142(33) 1.
O1 O2- 8 m 0.2496(8) 0 0.7102(16) . 1.
O2 O2- 4 i 0 0 0.2923(23) . 1.
O3 O2- 8 n 0.1265(7) 0.1855(14) 0 . 1.
O4 O2- 8 n 0.3706(7) 0.2159(14) 0 . 1.
loop_
_atom_site_aniso_label
_atom_site_aniso_type_symbol
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Pb1 Pb4+ 0.0070(3) 0.0037(3) 0.0039(3) 0 0 0
Pb2 Pb4+ 0.0061(4) 0.0059(4) 0.0050(4) 0 0 0
Rb1 Rb1+ 0.0184(9) 0.0249(11) 0.0179(10) 0 0 0
O1 O2- 0.0095(38) 0.0106(41) 0.0144(46) 0 -0.0024(37) 0
O2 O2- 0.0035(47) 0.0082(52) 0.0190(62) 0 0 0
O3 O2- 0.0030(34) 0.0114(41) 0.0141(41) 0.0015(32) 0 0
O4 O2- 0.0072(36) 0.0119(41) 0.0116(40) -0.0033(34) 0 0
#End of TTdata_35405-ICSD