PUMA

academical publication management
collect, organize, and share publications

( en | de )

 

Disambiguation of "Verstraelen, Toon"

Author of the publication

copydeleteadd this publication to your clipboard
The significance of fluctuating charges for molecular polarizability and dispersion coefficients

, and . The Journal of Chemical Physics, (Sep 7, 2023)
DOI: 10.1063/5.0163842

Please choose a person to relate this publication to

To differ between persons with the same name, the academic degree and the title of an important publication will be displayed. You can also use the button next to the name to display some publications already assigned to the person.

No persons found for author name Verstraelen, Toon
add a person with the name Verstraelen, Toon
 

Other publications of authors with the same name

Extension of the QuickFF force field protocol for an improved accuracy of structural, vibrational, mechanical and thermal properties of metal-organic frameworks., , , , , and . Journal of Computational Chemistry, 39 (16): 999-1011 (2018)MD-TRACKS: A Productive Solution for the Advanced Analysis of Molecular Dynamics and Monte Carlo simulations., , , and . Journal of Chemical Information and Modeling, 48 (12): 2414-2424 (2008)The significance of fluctuating charges for molecular polarizability and dispersion coefficients, and . The Journal of Chemical Physics, (Sep 7, 2023)QuickFF: A program for a quick and easy derivation of force fields for metal-organic frameworks from ab initio input., , , , , and . Journal of Computational Chemistry, 36 (13): 1015-1027 (2015)A new framework for frequency-dependent polarizable force fields, and . The Journal of Chemical Physics, (September 2022)ZEOBUILDER: A GUI Toolkit for the Construction of Complex Molecular Structures on the Nanoscale with Building Blocks., , and . Journal of Chemical Information and Modeling, 48 (7): 1530-1541 (2008)TAMkin: A Versatile Package for Vibrational Analysis and Chemical Kinetics., , , , and . Journal of Chemical Information and Modeling, 50 (9): 1736-1750 (2010)Improving the Silicon Interactions of GFN-xTB., and . J. Chem. Inf. Model., 61 (12): 5931-5937 (2021)GloMPO (Globally Managed Parallel Optimization): a tool for expensive, black-box optimizations, application to ReaxFF reparameterizations., and . J. Cheminformatics, 14 (1): 7 (2022)