Tom Bettens (T Bettens)

Publication Activity (10 Years)

Years Active: 2019-2023
Publications (10 Years): 6

Top Topics

Transition Metal

Density Functional Theory

Electron Microscopy

Capillary Electrophoresis

Top Venues

Chemistry (Weinheim an der Bergstrasse, Germany)

Chemical science

Physical chemistry chemical physics : PCCP

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

Publications

Mercedes Alonso, Tom Bettens, Jochen Eeckhoudt, Paul Geerlings, Frank de Proft
Wandering through quantum-mechanochemistry: from concepts to reactivity and switches. Physical chemistry chemical physics : PCCP (2023)
Jochen Eeckhoudt, Tom Bettens, P Geerlings, Roberto Cammi, Bo Chen, Mercedes Alonso, Frank de Proft
Conceptual density functional theory under pressure: Part I. XP-PCM method applied to atoms. Chemical science 13 (32) (2022)
Tom Bettens, Marvin Hoffmann, Mercedes Alonso, Paul Geerlings, Andreas Dreuw, Frank de Proft
Mechanochemically Triggered Topology Changes in Expanded Porphyrins. Chemistry (Weinheim an der Bergstrasse, Germany) 27 (10) (2021)
Tom Bettens, Mercedes Alonso, Frank de Proft, Trevor A Hamlin, Friedrich Matthias Bickelhaupt
Ambident Nucleophilic Substitution: Understanding Non-HSAB Behavior through Activation Strain and Conceptual DFT Analyses. Chemistry (Weinheim an der Bergstrasse, Germany) 26 (17) (2020)
Tom Bettens, Sudip Pan, Frank de Proft, Gernot Frenking, Paul Geerlings
Alkaline Earth Metals Activate N2 and CO in Cubic Complexes Just Like Transition Metals: A Conceptual Density Functional Theory and Energy Decomposition Analysis Study. Chemistry (Weinheim an der Bergstrasse, Germany) 26 (56) (2020)
Tom Bettens, Mercedes Alonso, Paul Geerlings, Frank de Proft
The hunt for reactive alkynes in bio-orthogonal click reactions: insights from mechanochemical and conceptual DFT calculations. Chemical science 11 (5) (2019)