Quantifying solvated electrons' delocalization

How far do electrons delocalize?

(2014) Benjamin G. Janesko et al.   JOURNAL OF CHEMICAL PHYSICS

Practical auxiliary basis implementation of Rung 3.5 functionals

(2014) Benjamin G. Janesko et al.   JOURNAL OF CHEMICAL PHYSICS

Optical Spectroscopy of the Bulk and Interfacial Hydrated Electron from Ab Initio Calculations

(2014) Frank Uhlig et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Excess Electrons Bound to Molecular Systems with a Vanishing Dipole but Large Molecular Quadrupole

(2014) Thomas Sommerfeld et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Extreme density-driven delocalization error for a model solvated-electron system

(2013) Erin R. Johnson et al.   JOURNAL OF CHEMICAL PHYSICS

Method for Visualizing and Quantifying the Nonvalence Character of Excess Electrons

(2013) Thomas Sommerfeld   Journal of Chemical Theory and Computation

Multielement NMR Studies of the Liquid–Liquid Phase Separation and the Metal-to-Nonmetal Transition in Fluid Lithium– and Sodium–Ammonia Solutions

(2013) Matthew T. J. H. Lodge et al.   JOURNAL OF PHYSICAL CHEMISTRY B

To Be or Not to Be in a Cavity: The Hydrated Electron Dilemma

(2013) Jennifer R. Casey et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Theoretical Studies of Spectroscopy and Dynamics of Hydrated Electrons

(2012) László Turi et al.   CHEMICAL REVIEWS

Characterizing the excess electron of Li(NH3)4

(2012) Thomas Sommerfeld et al.   JOURNAL OF CHEMICAL PHYSICS

Benchmark Calculations of the Energies for Binding Excess Electrons to Water Clusters

(2012) Victor P. Vysotskiy et al.   Journal of Chemical Theory and Computation

Unraveling the Complex Nature of the Hydrated Electron

(2012) Frank Uhlig et al.   Journal of Physical Chemistry Letters

Electron Tunneling in Lithium–Ammonia Solutions Probed by Frequency-Dependent Electron Spin Relaxation Studies

(2012) Kiminori Maeda et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Nature's most squishy ion: The important role of solvent polarization in the description of the hydrated electron

(2011) John M. Herbert et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

Structure of the Aqueous Electron: Assessment of One-Electron Pseudopotential Models in Comparison to Experimental Data and Time-Dependent Density Functional Theory

(2011) John M. Herbert et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Unveiling Electron Promiscuity

(2011) Dor Ben-Amotz   Journal of Physical Chemistry Letters

On the nature and signatures of the solvated electron in water

(2011) B. Abel et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

A diagnostic for determining the quality of single-reference electron correlation methods

(2010) Timothy J. Lee et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Correlation-bound anions of NaCl clusters

(2010) Thomas Sommerfeld et al.   JOURNAL OF CHEMICAL PHYSICS

Does the Hydrated Electron Occupy a Cavity?

(2010) R. E. Larsen et al.   SCIENCE

A Molecular Perspective on Lithium-Ammonia Solutions

(2009) Eva Zurek et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Some Fundamental Issues in Ground-State Density Functional Theory: A Guide for the Perplexed

(2009) John P. Perdew et al.   Journal of Chemical Theory and Computation

Formation and localization of a solvated electron in ground and low-lying excited states of Li(NH3)n and Li(H2O)n clusters: a comparison with Na(NH3)n and Na(H2O)n

(2009) Kenro Hashimoto et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Fractional spins and static correlation error in density functional theory

(2008) Aron J. Cohen et al.   JOURNAL OF CHEMICAL PHYSICS

Influence of Structure on Electron Correlation Effects and Electron−Water Dispersion Interactions in Anionic Water Clusters

(2008) Christopher F. Williams et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Excess Electrons Bound to Small Ammonia Clusters

(2008) Thomas Sommerfeld   JOURNAL OF PHYSICAL CHEMISTRY A

Model Potential Approaches for Describing the Interaction of Excess Electrons with Water Clusters: Incorporation of Long-Range Correlation Effects†

(2008) Thomas Sommerfeld et al.   JOURNAL OF PHYSICAL CHEMISTRY A