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Publications in Theoretical Chemistry

Analytic Derivative Couplings for Spin-Flip Configuration Interaction Singles and Spin-Flip Time-Dependent Density Functional Theory

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Dual Passivation of GaAs (110) Surfaces Using O2/H2o and Trimethylaluminum

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Publisher's Note: “Kinetics Following Addition of Sulfur Fluorides to a Weakly Ionized Plasma From 300 to 500 K: Rate Constants and Product Determinations for Ion–ion Mutual Neutralization and Thermal Electron Attachment to SF5, SF3, and SF2” [J. Chem. Phys. 133, 234304 (2010)]

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Organic–inorganic Hybrid Photocatalyst for Carbon Dioxide Reduction

Faraday Discussions

Theoretical Chemistry

Physical

2017

English

Hydrodynamic Coupling of Spherical Particles to a Planar Fluid-Fluid Interface: Theoretical Analysis

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

State-Dependent Biasing Method for Importance Sampling in the Weighted Stochastic Simulation Algorithm

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Metal Adsorbate Interactions and the Convergence of Density Functional Calculations

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Generalized Trajectory Surface-Hopping Method for Internal Conversion and Intersystem Crossing

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Communication: On the Difficulty of Reproducibly Measuring PbCl2 X-Ray Absorption Spectra

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Ab Initio Studies of Atomic Properties and Experimental Behavior of Element 119 and Its Lighter Homologs

Journal of Chemical Physics

Medicine

Theoretical Chemistry

English

Amanote Research

Discover open access scientific publications

Search, annotate, share and cite publications

Publications in Theoretical Chemistry

Analytic Derivative Couplings for Spin-Flip Configuration Interaction Singles and Spin-Flip Time-Dependent Density Functional Theory

Dual Passivation of GaAs (110) Surfaces Using O2/H2o and Trimethylaluminum

Publisher's Note: “Kinetics Following Addition of Sulfur Fluorides to a Weakly Ionized Plasma From 300 to 500 K: Rate Constants and Product Determinations for Ion–ion Mutual Neutralization and Thermal Electron Attachment to SF5, SF3, and SF2” [J. Chem. Phys. 133, 234304 (2010)]

Organic–inorganic Hybrid Photocatalyst for Carbon Dioxide Reduction

Hydrodynamic Coupling of Spherical Particles to a Planar Fluid-Fluid Interface: Theoretical Analysis

State-Dependent Biasing Method for Importance Sampling in the Weighted Stochastic Simulation Algorithm

Metal Adsorbate Interactions and the Convergence of Density Functional Calculations

Generalized Trajectory Surface-Hopping Method for Internal Conversion and Intersystem Crossing

Communication: On the Difficulty of Reproducibly Measuring PbCl2 X-Ray Absorption Spectra

Ab Initio Studies of Atomic Properties and Experimental Behavior of Element 119 and Its Lighter Homologs