Author

Marilù G. Maraldi

Observed name: Maraldi, Marilu

Institution: UCLouvain

Observed institutions: UCLouvain, KU Leuven

ORCID: 0009-0005-3877-6546

Observed ORCID: 0009-0005-3877-6546

OpenAlex ID: A5117068255

Evaluating the Performance of the Exact Integral Simplified Time-Dependent Density Functional Theory (XsTD-DFT) to Compute One- and Two-Photon Absorption

2025 · Marilù G. Maraldi, Marc de Wergifosse · The Journal of Physical Chemistry A · 11

All‐Atom Quantum Mechanical Methodologies for One‐ and Two‐Photon Absorption of Realistic Systems

2025 · Sarah Löffelsender, Marilù G. Maraldi, et al. · ChemPhysChem · 8

Simplified Time‐Dependent DFT for all‐Atom Simulations of Second Harmonic Generation Responses: A Case Study on Photoswitchable Azobenzene Monolayers

2026 · Matt Hugget, Angela Dellai, et al. · Journal of Computational Chemistry · 4

The std2 package: A computationally efficient program to calculate molecular response properties and excited states using simplified quantum chemistry methods

2026 · Pierre Beaujean, Axel Liger, et al. · The Journal of Chemical Physics · 1

Second Harmonic Generation of Spiropyran–Merocyanine Photoswitches: Insights From Hyper‐Rayleigh Scattering and All‐Atom Dynamic Structure Quantum Mechanical Calculations

2026 · Marilù G. Maraldi, Maxime Devuyst, et al. · Chemistry - A European Journal

Cover Feature: All‐Atom Quantum Mechanical Methodologies for One‐ and Two‐Photon Absorption of Realistic Systems (ChemPhysChem 11/2025)

2025 · Sarah Löffelsender, Marilù G. Maraldi, et al. · ChemPhysChem

Works count: 7

Citation count: 24

H-index: 3

I10-index: 1