Roy Edward Bruns (Roy E Bruns)

ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 11

Top Venues

The journal of physical chemistry. A

Analytical chemistry

Journal of chemical information and modeling

Journal of chemical theory and computation

Universidade Estadual de Campinas Instituto de Química

Oklahoma State University Stillwater (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Universidade Estadual de Campinas Instituto de Química Jun 01 1971

Brazil

Professor Emeritus :: Físico Química

Education History

Oklahoma State University Stillwater

United States

PHD :: Department of Chemistry

Publications

Gustavo Galo Marcheafave, Elis Daiane Pauli, Cláudia Domiciano Tormena, Leonardo José Duarte, Ivar Wendling, Miroslava Rakocevic, Amanda Lemos Quintela, Maria de Fátima Costa Santos, Cláudio Francisco Tormena, Ieda Spacino Scarminio, Roy Edward Bruns
1 H NMR Mixture Design-Fingerprints and ASCA Analysis in Ilex paraguariensis : Model Stability in Search of a Global Metabolome. Analytical chemistry (2023)
Leonardo J Duarte, Wagner Eduardo Richter, Roy Edward Bruns
Characteristic Substituent Effect Model for the Infrared Intensities of the X 2 CY (X = H, F, Cl, Br; Y = O, S) Molecules. The journal of physical chemistry. A (2023)
Leonardo J Duarte, Roy Edward Bruns
Energetic Origins of Force Constants: Adding a New Dimension to the Hessian Matrix via Interacting Quantum Atoms. The journal of physical chemistry. A 126 (48) (2022)
Leonardo J Duarte, Roy Edward Bruns
Electronic Distribution of S N 2 IRC and TS Structures: Infrared Intensities of Imaginary Frequencies. Journal of chemical theory and computation 18 (4) (2022)
Leonardo J Duarte, Wagner Eduardo Richter, Roy Edward Bruns, Paul L A Popelier
Electrostatics Explains the Reverse Lewis Acidity of BH3 and Boron Trihalides: Infrared Intensities and a Relative Energy Gradient (REG) Analysis of IQA Energies. The journal of physical chemistry. A 125 (39) (2021)
Wagner Eduardo Richter, Leonardo J Duarte, Roy Edward Bruns
Are "GAPT Charges" Really Just Charges? Journal of chemical information and modeling 61 (8) (2021)
Wagner Eduardo Richter, Leonardo J Duarte, Luciano Nassif Vidal, Roy Edward Bruns
AC/DC Analysis: Broad and Comprehensive Approach to Analyze Infrared Intensities at the Atomic Level. The journal of physical chemistry. A 125 (15) (2021)
Leonardo J Duarte, Roy Edward Bruns
QTAIM Atomic Charge and Polarization Parameters and Their Machine-Learning Transference among Boron-Halide Molecules. The journal of physical chemistry. A 124 (17) (2020)
Leonardo J Duarte, Arnaldo F Silva, Wagner E Richter, Roy Edward Bruns
Infrared Intensification and Hydrogen Bond Stabilization: Beyond Point Charges. The journal of physical chemistry. A 123 (30) (2019)
Leonardo J Duarte, Roy Edward Bruns
Atomic Polarizations, Not Charges, Determine CH Out-of-Plane Bending Intensities of Benzene Molecules. The journal of physical chemistry. A 122 (51) (2018)
Leonardo J Duarte, Wagner E Richter, Arnaldo F Silva, Roy Edward Bruns
Quantum Theory of Atoms in Molecules Charge-Charge Transfer-Dipolar Polarization Classification of Infrared Intensities. The journal of physical chemistry. A 121 (42) (2017)

Roy Edward Bruns.css-eqlu8i{font-size:small;padding-left:4px;} (Roy E Bruns)

Publication Activity (10 Years)

Top Topics

Top Venues

Roy Edward Bruns (Roy E Bruns)