First-principles calculation of electronic spectra of light-harvesting complex II

A Subsystem TDDFT Approach for Solvent Screening Effects on Excitation Energy Transfer Couplings

(2010) Johannes Neugebauer et al.   Journal of Chemical Theory and Computation

Structure-Based Identification of Energy Sinks in Plant Light-Harvesting Complex II

(2010) Frank Müh et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Structure-Based Calculations of Optical Spectra of Photosystem I Suggest an Asymmetric Light-Harvesting Process

(2010) Julian Adolphs et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Subsystem-Based Theoretical Spectroscopy of Biomolecules and Biomolecular Assemblies

(2009) Johannes Neugebauer   CHEMPHYSCHEM

Quantum Coherence Enabled Determination of the Energy Landscape in Light-Harvesting Complex II

(2009) Tessa R. Calhoun et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Theory of excitation energy transfer: from structure to function

(2009) Thomas Renger   PHOTOSYNTHESIS RESEARCH

Quantum chemical excited state calculations on pigment–protein complexes require thorough geometry re-optimization of experimental crystal structures

(2009) Andreas Dreuw et al.   THEORETICAL CHEMISTRY ACCOUNTS

Photoprotection in higher plants: The putative quenching site is conserved in all outer light-harvesting complexes of Photosystem II

(2008) Milena Mozzo et al.   BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS

Analysis of electron density distributions from subsystem density functional theory applied to coordination bonds

(2008) Samuel Fux et al.   CHEMICAL PHYSICS LETTERS

Photophysical Properties of Natural Light-Harvesting Complexes Studied by Subsystem Density Functional Theory

(2008) Johannes Neugebauer   JOURNAL OF PHYSICAL CHEMISTRY B

A flexible implementation of frozen-density embedding for use in multilevel simulations

(2007) Christoph R. Jacob et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY