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Publications by I. de P. R. Moreira

Comment on “About the Calculation of Exchange Coupling Constants Using Density-Functional Theory: The Role of the Self-Interaction Error” [J. Chem. Phys. 123, 164110 (2005)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

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Comment on ‘‘Density Functional Calculation of Nuclear Magnetic Resonance Chemical Shifts’’ [J. Chem. Phys. 102, 2806 (1995)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Publisher’s Note: “Comment on ‘Preserving the Boltzmann Ensemble in Replica-Exchange Molecular Dynamics’ [J. Chem. Phys. 129, 164112 (2008)]” [J. Chem. Phys. 132, 127101 (2010)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Erratum: Determination of Dipole Coupling Constants Using Heteronuclear Multiple Quantum NMR [J. Chem. Phys. 77, 2870 (1982)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Comment on “Preserving the Boltzmann Ensemble in Replica-Exchange Molecular Dynamics” [J. Chem. Phys. 129, 164112 (2008)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Comment on “An Exact Quantum Monte Carlo Calculation of the Helium–helium Intermolecular Potential” [J. Chem. Phys. 115, 4546 (2001)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Response to “Comment on ‘Communication: Tolman Length and Rigidity Constants of Water and Their Role in Nucleation”’ [J. Chem. Phys. 143, 217101 (2015)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Comment on “The Dependence of Homogeneous Nucleation Rate on Supersaturation” [J. Chem. Phys. 141, 024307 (2014)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Erratum: Simulated Annealing Using the Classical Density Distribution [J. Chem. Phys. 101, 533 (1994)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Density Functional Theory Study of 14N Isotropic Hyperfine Coupling Constants of Organic Radicals

English

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Discover open access scientific publications

Search, annotate, share and cite publications

Publications by I. de P. R. Moreira

Comment on “About the Calculation of Exchange Coupling Constants Using Density-Functional Theory: The Role of the Self-Interaction Error” [J. Chem. Phys. 123, 164110 (2005)]

Related publications

Comment on ‘‘Density Functional Calculation of Nuclear Magnetic Resonance Chemical Shifts’’ [J. Chem. Phys. 102, 2806 (1995)]

Publisher’s Note: “Comment on ‘Preserving the Boltzmann Ensemble in Replica-Exchange Molecular Dynamics’ [J. Chem. Phys. 129, 164112 (2008)]” [J. Chem. Phys. 132, 127101 (2010)]

Erratum: Determination of Dipole Coupling Constants Using Heteronuclear Multiple Quantum NMR [J. Chem. Phys. 77, 2870 (1982)]

Comment on “Preserving the Boltzmann Ensemble in Replica-Exchange Molecular Dynamics” [J. Chem. Phys. 129, 164112 (2008)]

Comment on “An Exact Quantum Monte Carlo Calculation of the Helium–helium Intermolecular Potential” [J. Chem. Phys. 115, 4546 (2001)]

Response to “Comment on ‘Communication: Tolman Length and Rigidity Constants of Water and Their Role in Nucleation”’ [J. Chem. Phys. 143, 217101 (2015)]

Comment on “The Dependence of Homogeneous Nucleation Rate on Supersaturation” [J. Chem. Phys. 141, 024307 (2014)]

Erratum: Simulated Annealing Using the Classical Density Distribution [J. Chem. Phys. 101, 533 (1994)]

Density Functional Theory Study of 14N Isotropic Hyperfine Coupling Constants of Organic Radicals