Search filters

List of works by Maarten T. P. Beerepoot

A generalized few-state model for the first hyperpolarizability

scientific article published on 01 June 2020

A polarizable embedding DFT study of one-photon absorption in fluorescent proteins.

scientific article published in April 2013

Acetyl group orientation modulates the electronic ground-state asymmetry of the special pair in purple bacterial reaction centers.

scientific article published on 21 April 2011

An averaged polarizable potential for multiscale modeling in phospholipid membranes.

scientific article published on 3 February 2017

Analysis of computational models for an accurate study of electronic excitations in GFP.

scientific article published on 10 December 2014

Averaged Solvent Embedding Potential Parameters for Multiscale Modeling of Molecular Properties

scientific article published on 14 March 2016

Benchmarking two-photon absorption cross sections: performance of CC2 and CAM-B3LYP.

scientific article published in July 2015

Channel interference in multiphoton absorption

scientific article

Convergence of environment polarization effects in multiscale modeling of excitation energies

Correction: Analysis of computational models for an accurate study of electronic excitations in GFP.

scientific article published on 15 December 2015

Electronic circular dichroism of fluorescent proteins: a computational study

scientific article published on 17 February 2015

Harmonic Infrared and Raman Spectra in Molecular Environments Using the Polarizable Embedding Model

scientific article published on 19 May 2021

Intermolecular charge transfer enhances two-photon absorption in yellow fluorescent protein.

scientific article published in April 2014

Molecular quantum mechanical gradients within the polarizable embedding approach—Application to the internal vibrational Stark shift of acetophenone

scientific article published on 01 January 2015

Open-Ended Recursive Approach for the Calculation of Multiphoton Absorption Matrix Elements

scientific article published on 11 February 2015

Open-ended formulation of self-consistent field response theory with the polarizable continuum model for solvation.

scientific article

Open-ended response theory with polarizable embedding: multiphoton absorption in biomolecular systems.

scientific article

Rotational averaging of multiphoton absorption cross sections

scientific article published in November 2014