Search filters

List of works by Cheng-Chau Chiu

C-O cleavage of aromatic oxygenates over ruthenium catalysts. A computational study of reactions at step sites.

scientific article published in June 2015

Improved agreement between experimental and computational results for collision-induced dissociation mass spectrometry of cation-tagged hexoses

scientific article published on 01 April 2020

Influence of nonmetal dopants on charge separation of graphitic carbon nitride by time-dependent density functional theory

scientific article published on 01 January 2020

Molecular understandings on the activation of light hydrocarbons over heterogeneous catalysts.

scientific article published on 12 June 2015

Predicting adsorption enthalpies on silicalite and HZSM-5: A benchmark study on DFT strategies addressing dispersion interactions

scientific article published on 18 February 2014

Structure and electronic properties of MoVO type mixed-metal oxides - a combined view by experiment and theory

scientific article published on July 2015

Structures and infrared spectra of calcium phosphate clusters by ab initio methods with implicit solvation models.

scientific article published on 6 December 2017

Toward Closing the Gap between Hexoses and N-Acetlyhexosamines: Experimental and Computational Studies on the Collision-Induced Dissociation of Hexosamines

scientific article published on 26 July 2019

Transformations of Organic Molecules over Metal Surfaces: Insights from Computational Catalysis

scientific article published on 15 August 2016

Tunable Gravimetric and Volumetric Hydrogen Storage Capacities in Polyhedral Oligomeric Silsesquioxane Frameworks

scientific article published on 16 September 2016

Tuning the vibrational coupling of H3O+ by changing its solvation environment

scientific article published on 28 October 2016

Unexpected Dissociation Mechanism of Sodiated N-Acetylglucosamine and N-Acetylgalactosamine

scientific article published on 16 April 2019

Paulina is supported by:

About Paulina

Help