相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。Photoelectron spectroscopy of hydrated electrons
Alexander T. Shreve et al.
CHEMICAL PHYSICS LETTERS (2010)
A new electron-methanol molecule pseudopotential and its application for the solvated electron in methanol
Letif Mones et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Application of the Diffusion Monte Carlo Method to the Binding of Excess Electrons to Water Clusters
J. Xu et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
Solvated Electron Extinction Coefficient and Oscillator Strength in High Temperature Water
Patrick M. Hare et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
Polarization-Bound Quasi-Continuum States Are Responsible for the Blue Tail in the Optical Absorption Spectrum of the Aqueous Electron
Leif D. Jacobson et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Binding energies, lifetimes and implications of bulk and interface solvated electrons in water
Katrin R. Siefermann et al.
NATURE CHEMISTRY (2010)
Direct measurement of vertical binding energy of a hydrated electron
Ying Tang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Does the Hydrated Electron Occupy a Cavity?
Ross E. Larsen et al.
SCIENCE (2010)
The static-exchange electron-water pseudopotential, in conjunction with a polarizable water model: A new Hamiltonian for hydrated-electron simulations
Leif D. Jacobson et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Electronic relaxation dynamics in large anionic water clusters: (H2O)n- and (D2O)n- (n=25-200)
Graham B. Griffin et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Nuclear quantum effects in electronically adiabatic quantum time correlation functions: Application to the absorption spectrum of a hydrated electron
Laszlo Turi et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Low temperature photoelectron spectra of water cluster anions
Lei Ma et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Interior- and surface-bound excess electron states in large water cluster anions
Adam Madarasz et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Hydrated Electron Diffusion: The Importance of Hydrogen-Bond Dynamics
Kafui A. Tay et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Pump-probe polarized transient hole burning (PTHB) dynamics of hydrated electron revisited
Ilya A. Shkrob
CHEMICAL PHYSICS LETTERS (2008)
Parallel tempering Monte Carlo simulations of the water heptamer anion
Albert DeFusco et al.
CHEMICAL PHYSICS LETTERS (2008)
Photoelectron spectra of hydrated electron clustersvs.cluster size: connecting to bulk
James V. Coe et al.
INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY (2008)
Exploring the correlation between network structure and electron binding energy in the (H2O)7- cluster through isomer-photoselected vibrational predissociation spectroscopy and ab initio calculations:: Addressing complexity beyond types I-III
Joseph R. Roscioli et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Influence of structure on electron correlation effects and electron-water dispersion interactions in anionic water clusters
Christopher F. Williams et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2008)
Water cluster anions studied by the long-range corrected density functional theory
Kiyoshi Yagi et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2008)
Nuclear quantum effects on the nonadiabatic decay mechanism of an excited hydrated electron
Daniel Borgis et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Excess electron relaxation dynamics at water/air interfaces
Adam Madarasz et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
The structure of the hydrated electron. Part 1. Magnetic resonance of internally trapping water anions: A density functional theory study
Ilya A. Shkrob
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
The structure of the hydrated electron. Part 2. A mixed quantum/classical molecular dynamics embedded cluster density functional theory: Single-excitation configuration interaction study
Ilya A. Shkrob et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Vibrational spectroscopy of hydrated electron clusters (H2O)15-50- via infrared multiple photon dissociation
Knut R. Asmis et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Solvated electron spectrum in supercooled water and ice
Yikui Du et al.
CHEMICAL PHYSICS LETTERS (2007)
Charge penetration and the origin of large O-H vibrational red-shifts in hydrated-electron clusters, (H2O)n-
John M. Herbert et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
First-principles, quantum-mechanical simulations of electron solvation by a water cluster
John M. Herbert et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2006)
A computationally efficient exact pseudopotential method. I. Analytic reformulation of the Phillips-Kleinman theory
C. Jay Smallwood et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Quantized time correlation function approach to nonadiabatic decay rates in condensed phase: Application to solvated electrons in water and methanol
Daniel Borgis et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Excess electron localization sites in neutral water clusters
Laszlo Turi et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Photoelectron spectra of hydrated electron clusters: Fitting line shapes and grouping isomers
James V. Coe et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Advances in methods and algorithms in a modern quantum chemistry program package
Yihan Shao et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2006)
Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters
JM Herbert et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2006)
Vibrational predissociation spectroscopy of the (H2O)-6-21clusters in the OH stretching region:: Evolution of the excess electron-binding signature into the intermediate cluster size regime -: art. no. 244311
NI Hammer et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Electronic relaxation dynamics of water cluster anions
AE Bragg et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
Identification of two distinct electron binding motifs in the anionic water clusters:: A vibrational spectroscopic study of the (H2O)6- isomers
NI Hammer et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2005)
Characterization of excess electrons in water-cluster anions by quantum simulations
L Turi et al.
SCIENCE (2005)
Calculation of electron detachment energies for water cluster anions:: An appraisal of electronic structure methods, with application to (H2O)(20)over-bar and (H2O)(24)over-bar
JM Herbert et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2005)
Pulse radiolysis of supercritical water. 3. Spectrum and thermodynamics of the hydrated electron
DM Bartels et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2005)
Observation of large water-cluster anions with surface-bound excess electrons
JRR Verlet et al.
SCIENCE (2005)
Revisiting the pump-probe polarized transient hole-burning of the hydrated electron: Is its absorption spectrum inhomogeneously broadened?
MC Cavanagh et al.
CHEMICAL PHYSICS LETTERS (2004)
Temperature and pressure dependence of the AMOEBA water model
PY Ren et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Hydrated electron dynamics: From clusters to bulk
AE Bragg et al.
SCIENCE (2004)
How do small water clusters bind an excess electron?
NI Hammer et al.
SCIENCE (2004)
Electrons in finite-sized water cavities: Hydration dynamics observed in real time
DH Paik et al.
SCIENCE (2004)
The structure of the first coordination shell in liquid water
P Wernet et al.
SCIENCE (2004)
Parallel-tempering Monte Carlo simulations of the finite temperature behavior of (H2O)6-
F Wang et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Polarizable atomic multipole water model for molecular mechanics simulation
PY Ren et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
First-principles molecular-dynamics simulations of a hydrated electron in normal and supercritical water
M Boero et al.
PHYSICAL REVIEW LETTERS (2003)
Picosecond time-resolved resonance Raman study of the solvated electron in water
M Mizuno et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
Structure of the aqueous solvated electron from resonance Raman spectroscopy: Lessons from isotopic mixtures
MJ Tauber et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
Analytical investigations of an electron-water molecule pseudopotential. II. Development of a new pair potential and molecular dynamics simulations
L Turi et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Application of a Drude model to the binding of excess electrons to water clusters
F Wang et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Resonance Raman spectra and vibronic analysis of the aqueous solvated electron
MJ Tauber et al.
CHEMICAL PHYSICS LETTERS (2002)
Fluorescence and resonance Raman spectra of the aqueous solvated electron
MJ Tauber et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2001)
Novel resonance Raman enhancement of local structure around solvated electrons in water
M Mizuno et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2001)
Moment analysis of hydrated electron cluster spectra: Surface or internal states?
DM Bartels
JOURNAL OF CHEMICAL PHYSICS (2001)
A long-range correction scheme for generalized-gradient-approximation exchange functionals
H Iikura et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
Ab initio atomistic dynamical study of an excess electron in water
I Park et al.
COMPUTATIONAL MATERIALS SCIENCE (2001)
Analytical investigations of an electron-water molecule pseudopotential. I. Exact calculations on a model system
L Turi et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
分享论文
