In this work, a method is described to extend the iterative Hirshfeld‐I method, generally used
for molecules, to periodic systems. The implementation makes use of precalculated …

The extended charge equilibration (EQeq) scheme computes atomic partial charges using
the experimentally measured ionization potentials and electron affinities of atoms. However …

A series of compounds based on vanadate,[Zn (1, 10-phen) 3][Zn (dap) 2] 0.5 [Zn (dap) 2
(H2O)] 2 [VV6VIV10O38Cl]· 2H2O (1),[Ni (im) 6] 3 [VV7VIV8O36Cl]· 17H2O (2),[Zn (2, 2 …

A series of organically templated vanadium selenites have been prepared under mild
hydrothermal conditions. Single crystals were grown from mixtures of VOSO4, SeO2, and …

The new uranyl aqua sulfate compound [({CH 3} 3 N 2 C 3 H 3 {CH 2 COOH})(H 3 O)][(UO 2)
2 (SO 4) 3 (H 2 O)]· 1.5 H 2 O was synthesized and the crystal structure determined. The two …

A set of formation principles governing organically templated vanadium selenite oxalates
are described in the context of nine new compounds. The compositions of the reaction …

The structural and electronic adaptability ranges of a [VO (SeO3)(HSeO3)] framework found
in organically templated vanadium selenites were determined using a three step approach …

Structural differences in [V2Te2O10] n 2 n–chain metrics are directly ascribed to variations in
noncovalent interactions in a series of organically templated vanadium tellurites, including …

The structural adaptability of [V 3 O 5 (SeO 3) 3] n 2 n− layers in organically templated
vanadium selenites was determined using a three step approach involving (i) an 84 reaction …

A series of organically templated vanadium selenites has been prepared under mild
hydrothermal conditions. Single crystals of [C5H14N2][(VO) 3 (SeO3) 2 (HSeO3) …