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Publications by Koichiro Kato

Nuclear Quantum Effects of Light and Heavy Water Studied by All-Electron First Principles Path Integral Simulations

Journal of Chemical Physics

Theoretical Chemistry

English

Related publications

Water Properties From First Principles: Simulations by a General-Purpose Quantum Mechanical Polarizable Force Field

Proceedings of the National Academy of Sciences of the United States of America

Multidisciplinary

English

“On-The-Fly” Coupled Cluster Path-Integral Molecular Dynamics: Impact of Nuclear Quantum Effects on the Protonated Water Dimer

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Heavy Ion Ranges From First-Principles Electron Dynamics

npj Computational Materials

Mechanics of Materials

Materials Science

Computer Science Applications

English

Correction: “On-The-Fly” Coupled Cluster Path-Integral Molecular Dynamics: Impact of Nuclear Quantum Effects on the Protonated Water Dimer

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

First Principles Simulations

Le Journal de Physique IV

English

Path-Integral Quantum PATHTREE and PATHINT Algorithms

SSRN Electronic Journal

English

Erratum: Thermodynamic Effects of Mixing Light and Heavy Water

Journal of Chemical Physics

Theoretical Chemistry

English

From Light to Heavy Nuclear Systems, Production and Decay of Fragments Studied With Powerful Arrays

Acta Physica Polonica A

English

All-Electron First-Principles Investigations of the Energetics of Vicinal Cu Surfaces

Physical Review B

English