Theory of dipole-bound anions

KD Jordan, F Wang - Annual review of physical chemistry, 2003 - annualreviews.org
▪ Abstract The problem of the binding of an excess electron to polar molecules and their
clusters has long fascinated researchers. Although excess electrons bound to such species …

Theoretical studies of spectroscopy and dynamics of hydrated electrons

L Turi, PJ Rossky - Chemical reviews, 2012 - ACS Publications
The hydrated electron is a fascinating species that has captured the scientific attention of
chemists for more than 50 years. Although the experimental detection of the hydrated …

Clusters: Structure, energetics, and dynamics of intermediate states of matter

AW Castleman, KH Bowen - The Journal of Physical Chemistry, 1996 - ACS Publications
The field of cluster research can trace its origins back to the mid-nineteenth century when
early studies of colloids, aerosols, and nucleation phenomena were reported. The field …

Excess electrons in liquid water: first evidence of a prehydrated state with femtosecond lifetime

A Migus, Y Gauduel, JL Martin, A Antonetti - Physical review letters, 1987 - APS
The localization and solvation of excess electrons in pure water have been resolved at the
femtosecond time scale. Before it becomes solvated, the electron thermalizes and reaches …

Ab initio electronic structure of anions

J Simons, KD Jordan - Chemical Reviews, 1987 - ACS Publications
In characterizing anion states either experimentally or theoretically different techniques are
required for bound and temporary or metastable anions. Anions that lie energetically above …

The hydrated electron: quantum simulation of structure, spectroscopy, and dynamics

PJ Rossky, J Schnitker - The Journal of Physical Chemistry, 1988 - ACS Publications
We have shown that the fluorescence lifetime of the polysilane, poly (di-n-hexylsilane), is
significantly increased in crystalline forms. This is attributed to a decrease in the rate of …

Dipole bound, nucleic acid base anions studied via negative ion photoelectron spectroscopy

JH Hendricks, SA Lyapustina, HL De Clercq… - The Journal of …, 1996 - pubs.aip.org
The anions of the nucleic acid bases, uracil and thymine, were studied by negative ion
photoelectron spectroscopy. Both monomer anions exhibit spectroscopic signatures that are …

Energy‐structure relationships for microscopic solvation of anions in water clusters

JE Combariza, NR Kestner, J Jortner - The Journal of chemical physics, 1994 - pubs.aip.org
In this paper we present a quantum‐mechanical study of anions in water clusters, X−(H2O) n
(X= Cl, Br, I, and n= 1–6). Molecular orbital calculations at the self‐consistent field (SCF) …

Electron localization in water clusters. II. Surface and internal states

RN Barnett, U Landman, CL Cleveland… - The Journal of chemical …, 1988 - pubs.aip.org
Electron attachment and localization in small water clusters (H2O) n (n= 8–128) is studied
using path‐integral molecular dynamics simulations. The electron‐water molecule …

The electron transfer mechanism between metal and amorphous polymers in humidity environment for triboelectric nanogenerator

L Li, X Wang, P Zhu, H Li, F Wang, J Wu - Nano Energy, 2020 - Elsevier
Humidity tends to deteriorate the output performance and the stability of triboelectric
nanogenerator (TENG). However, the microscopic mechanism of how water molecules …