Thijs J H Vlugt

65PUBLICATIONS
98CO-AUTHORS
Physical properties of materialsGroundwater quality processes and contaminated land assessmentElectrochemical energy storage and conversionEcohydrologyTransport properties and non-equilibrium processes
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (65)

|Jul 18, 2026
Inclusion Complexation of Native and Functionalized α-, β-, and γ-Cyclodextrins with PFAS: An Experimental and Molecular Simulation Study.

|Apr 24, 2026
Predicting Absorption and Diffusion of Plasma-Generated O(3P), O(1D), and Other RONS in Aqueous Environments Using Molecular Simulations.

|Feb 04, 2026
Electrochemical CO2 Reduction in the Presence of SO2 Impurities on a Nitrogen-Doped Carbon Electrocatalyst.

Shilong Fu, Bowen Sha, Asvin Sajeev

|Jan 20, 2026
Electrical Conductivity Differences between Experiments and Classical Simulations Reveal Self-Diffusion Coefficients and Ion Lifetimes of Hydroxide and Hydronium in Aqueous Solutions.

V Jelle Lagerweij, Othonas A Moultos, Thijs J H Vlugt

|Dec 29, 2025
Coupling Solvation Thermodynamics and Chemical Speciation: A Simulation-Based Approach to NOx Uptake in Aqueous Environments.

Tijin H G Saji, Thijs J H Vlugt, Sofia Calero

|Dec 10, 2025
Molecular Simulation of Hydrogen Systems: From Properties and Methods to Applications and Future Directions.

Ahmadreza Rahbari, Thejas Hulikal Chakrapani, Fei Shuang

Pageof 11

Frequent Collaborators

40 joint publications

Othonas A Moultos

13 joint publications

Mahinder Ramdin

13 joint publications

David Dubbeldam

12 joint publications

Sofia Calero