Changru Ma

Capture and Release of CO₂ in Monoethanolamine Aqueous Solutions: New Insights from First-Principles Reaction Dynamics

Changru Ma, Fabio Pietrucci, Wanda Andreoni · Journal of Chemical Theory and Computation · 2015 · 71 citations · Full text

Carbon Dioxide, Chemical Engineering, Molecular Kinetics +14

Reaction Mechanisms of Water Splitting and H₂ Evolution by a Ru(II)-Pincer Complex Identified with Ab Initio Metadynamics Simulations

Changru Ma, Simone Piccinin, Stefano Fabris · ACS Catalysis · 2012 · 45 citations

Engineering, Computational Chemistry, Chemistry +18

Capturing CO₂ in Monoethanolamine (MEA) Aqueous Solutions: Fingerprints of Carbamate Formation Assessed with First-Principles Simulations

Changru Ma, Fabio Pietrucci, Wanda Andreoni · The Journal of Physical Chemistry Letters · 2014 · 39 citations

First-principles Simulations, Engineering, Chemical Analysis +19

Selective Synthesis of THF-Derived Amines from Biomass-Derived Carbonyl Compounds

Shi Jiang, Changru Ma, E. Müller et al. · ACS Catalysis · 2019 · 39 citations · Full text

Engineering, Bioenergy, Organic Chemistry +17

A Combined Experimental–Theoretical Study on Diels‐Alder Reaction with Bio‐Based Furfural: Towards Renewable Aromatics

Ivan Scodeller, Karine De Oliveira Vigier, E. Müller et al. · ChemSusChem · 2020 · 34 citations · Full text