The role of charge-transfer states in the spectral tuning of antenna complexes of purple bacteria

An Ab Initio Exciton Model Including Charge-Transfer Excited States

(2017) Xin Li et al.   Journal of Chemical Theory and Computation

EXAT: EXcitonic analysis tool

(2017) Sandro Jurinovich et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Intermolecular Modes between LH2 Bacteriochlorophylls and Protein Residues: The Effect on the Excitation Energies

(2017) André Anda et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Quantum Chemical Studies of Light Harvesting

(2016) Carles Curutchet et al.   CHEMICAL REVIEWS

Combining classical molecular dynamics and quantum mechanical methods for the description of electronic excitations: The case of carotenoids

(2016) Ingrid G. Prandi et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

An Ab Initio Description of the Excitonic Properties of LH2 and Their Temperature Dependence

(2016) Lorenzo Cupellini et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Electrostatic versus Resonance Interactions in Photoreceptor Proteins: The Case of Rhodopsin

(2016) Riccardo Guareschi et al.   Journal of Physical Chemistry Letters

Dark States in the Light-Harvesting complex 2 Revealed by Two-dimensional Electronic Spectroscopy

(2016) Marco Ferretti et al.   Scientific Reports

Electronic Excitations in Solution: The Interplay between State Specific Approaches and a Time-Dependent Density Functional Theory Description

(2015) Ciro A. Guido et al.   Journal of Chemical Theory and Computation

Molecular Level Design Principle behind Optimal Sizes of Photosynthetic LH2 Complex: Taming Disorder through Cooperation of Hydrogen Bonding and Quantum Delocalization

(2015) Seogjoo Jang et al.   Journal of Physical Chemistry Letters

High Efficiency Light Harvesting by Carotenoids in the LH2 Complex from Photosynthetic Bacteria: Unique Adaptation to Growth under Low-Light Conditions

(2014) Nikki M. Magdaong et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Theoretical Study on Excited States of Bacteriochlorophyll a in Solutions with Density Functional Assessment

(2014) Masahiro Higashi et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A multi-state fragment charge difference approach for diabatic states in electron transfer: Extension and automation

(2013) Chou-Hsun Yang et al.   JOURNAL OF CHEMICAL PHYSICS

Excitons in the LH3 Complexes from Purple Bacteria

(2013) Jevgenij Chmeliov et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Davydov Splitting of Excitons in Cyclic Bacteriochlorophyll a Nanoaggregates of Bacterial Light-Harvesting Complexes between 4.5 and 263 K

(2011) Mihkel Pajusalu et al.   CHEMPHYSCHEM

Photosynthetic Light-Harvesting Is Tuned by the Heterogeneous Polarizable Environment of the Protein

(2011) Carles Curutchet et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Spectral fine-tuning in excitonically coupled cyclic photosynthetic antennas

(2010) Arvi Freiberg et al.   CHEMICAL PHYSICS LETTERS

Electronic Energy Transfer in Condensed Phase Studied by a Polarizable QM/MM Model

(2009) Carles Curutchet et al.   Journal of Chemical Theory and Computation

Characterization of the Short-Range Couplings in Excitation Energy Transfer

(2008) Chao-Ping Hsu et al.   Journal of Physical Chemistry C