Perturbation Raman spectroscopy has underscored the hydrogen bond (O: H–O or HB)
cooperativity and polarizability (HBCP) for water, which offers a proper parameter space for …

Deep engineering of liquid water by charge and impurity injection, charged support, current
flow, hydrophobic confinement, or applying a directional field has becoming increasingly …

We have revised the structures of neutral water clusters,(H2O) n= 2–30, with the affordable
M06-2X functional, presenting up to 25 isomers for each cluster size. Besides, relative …

Aqueous charge injection in forms of electrons, protons, lone pairs, ions, and molecular
dipoles by solvation is ubiquitously important to our health and life. Pursuing fine-resolution …

Electromagnetic bioeffects remain an enigma from both the experimental and theoretical
perspectives despite the ubiquitous presence of related technologies in contemporary life …

We consider carbon monoxide (CO) confined in the hydrogen-bonded building blocks of sI
and sII clathrate hydrates, viz.,(512, 51262, 51264) cages, within the density functional …

We have investigated the reaction mechanisms and kinetics of water, water dimer, or formic
acid catalyzed gas-phase isomerization of α-nitroguanidine to β-nitroguanidine by means of …

The electric field can change the absorption of fullerene C 60 to different wavelengths of
light by affecting the vibrational modes and electronic transitions. The IR spectrum of …

Evolutions in the restructuring of vibrational spectrum and electronic structure of fullerene C
60 in the electric field within the range of values E= 0− 0.5 V/Å were investigated using the …

By applying a low-intensity microwave to DMSO–primary alcohol mixtures, distinct dielectric
property changes have been observed. The results indicated that the intermolecular …