Dynamics of the Bulk Hydrated Electron from Many-Body Wave-Function Theory

Toward GW Calculations on Thousands of Atoms

(2018) Jan Wilhelm et al.   Journal of Physical Chemistry Letters

Electron affinity of liquid water

(2018) Alex P. Gaiduk et al.   Nature Communications

Electronic Levels of Excess Electrons in Liquid Water

(2017) Francesco Ambrosio et al.   Journal of Physical Chemistry Letters

Nuclear Quantum Effects on Aqueous Electron Attachment and Redox Properties

(2017) Vladimir V. Rybkin et al.   Journal of Physical Chemistry Letters

Genuine binding energy of the hydrated electron

(2017) David Luckhaus et al.   Science Advances

Perspective: How good is DFT for water?

(2016) Michael J. Gillan et al.   JOURNAL OF CHEMICAL PHYSICS

Short-Range Electron Correlation Stabilizes Noncavity Solvation of the Hydrated Electron

(2016) William J. Glover et al.   Journal of Chemical Theory and Computation

Spin-Unrestricted Second-Order Møller–Plesset (MP2) Forces for the Condensed Phase: From Molecular Radicals to F-Centers in Solids

(2016) Vladimir V. Rybkin et al.   Journal of Chemical Theory and Computation

Time-Resolved Photoelectron Spectroscopy of the Hydrated Electron: Comparing Cavity and Noncavity Models to Experiment

(2016) Chen-Chen Zho et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The Hydrated Electron at the Surface of Neat Liquid Water Appears To Be Indistinguishable from the Bulk Species

(2016) Marc P. Coons et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Calculation of Electrochemical Energy Levels in Water Using the Random Phase Approximation and a Double Hybrid Functional

(2016) Jun Cheng et al.   PHYSICAL REVIEW LETTERS

Probing the structural and dynamical properties of liquid water with models including non-local electron correlation

(2015) Mauro Del Ben et al.   JOURNAL OF CHEMICAL PHYSICS

Forces and stress in second order Møller-Plesset perturbation theory for condensed phase systems within the resolution-of-identity Gaussian and plane waves approach

(2015) Mauro Del Ben et al.   JOURNAL OF CHEMICAL PHYSICS

Hydrated Electrons in Water Clusters: Inside or Outside, Cavity or Noncavity?

(2015) László Turi   Journal of Chemical Theory and Computation

A Simple ab Initio Model for the Hydrated Electron That Matches Experiment

(2015) Anil Kumar et al.   JOURNAL OF PHYSICAL CHEMISTRY A

The solvation of electrons by an atmospheric-pressure plasma

(2015) Paul Rumbach et al.   Nature Communications

Direct observation of the collapse of the delocalized excess electron in water

(2014) Janne Savolainen et al.   Nature Chemistry

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

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

Structure, Dynamics, and Reactivity of Hydrated Electrons by Ab Initio Molecular Dynamics

(2011) Ondrej Marsalek et al.   ACCOUNTS OF CHEMICAL RESEARCH

The Hydrated Electron: A Seemingly Familiar Chemical and Biological Transient

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Response to Comments on "Does the Hydrated Electron Occupy a Cavity?"

(2011) R. E. Larsen et al.   SCIENCE

Comment on "Does the Hydrated Electron Occupy a Cavity?"

(2011) L. Turi et al.   SCIENCE

Comment on "Does the Hydrated Electron Occupy a Cavity?"

(2011) L. D. Jacobson et al.   SCIENCE

A one-electron model for the aqueous electron that includes many-body electron-water polarization: Bulk equilibrium structure, vertical electron binding energy, and optical absorption spectrum

(2010) Leif D. Jacobson et al.   JOURNAL OF CHEMICAL PHYSICS

Electrons in Cold Water Clusters: An ab Initio Molecular Dynamics Study of Localization and Metastable States

(2010) Ondrej Marsalek et al.   Journal of Physical Chemistry C

Polarization-Bound Quasi-Continuum States Are Responsible for the “Blue Tail” in the Optical Absorption Spectrum of the Aqueous Electron

(2010) Leif D. Jacobson et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Binding energies, lifetimes and implications of bulk and interface solvated electrons in water

(2010) Katrin R. Siefermann et al.   Nature Chemistry

Direct measurement of vertical binding energy of a hydrated electron

(2010) Ying Tang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Does the Hydrated Electron Occupy a Cavity?

(2010) R. E. Larsen et al.   SCIENCE

Localization and Delocalization Errors in Density Functional Theory and Implications for Band-Gap Prediction

(2008) Paula Mori-Sánchez et al.   PHYSICAL REVIEW LETTERS