Iterative Implementation of the Dipole Interaction Model for Atomic Polarizabilities

von Ligorio, Raphael F
Veröffentlicht in: Journal of computational chemistry (2025)

A building-block database of distributed polarizabilities and dipole moments to estimate optical properties of biomacromolecules in isolation or in an explicitly solvated medium

von Ligório, Raphael F
Veröffentlicht in: Journal of computational chemistry (2023)