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Probing exciton diffusion dynamics in photosynthetic supercomplexes via exciton–exciton annihilation
Single-file diffusion of active Brownian particles
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COMMUNICATIONS
SOFTWARE
The Amsterdam Modeling Suite
Evert Jan Baerends; Nestor F. Aguirre; Nick D. Austin; Jochen Autschbach; F. Matthias Bickelhaupt; Rosa Bulo; Chiara Cappelli; Adri C. T. van Duin; Franco Egidi; Célia Fonseca Guerra; Arno Förster; Mirko Franchini; Theodorus P. M. Goumans; Thomas Heine; Matti Hellström; Christoph R. Jacob; Lasse Jensen; Mykhaylo Krykunov; Erik van Lenthe; Artur Michalak; Mariusz M. Mitoraj; Johannes Neugebauer; Valentin Paul Nicu; Pier Philipsen; Harry Ramanantoanina; Robert Rüger; Georg Schreckenbach; Mauro Stener; Marcel Swart; Jos M. Thijssen; Tomáš Trnka; Lucas Visscher; Alexei Yakovlev; Stan van Gisbergen
J. Chem. Phys. 162, 162501 (2025)
https://doi.org/10.1063/5.0258496
ARTICLES
Theoretical Methods and Algorithms
Data efficient learning of molecular slow modes from nonequilibrium metadynamics
In Special Collection:
Michele Parrinello Festschrift
J. Chem. Phys. 162, 164101 (2025)
https://doi.org/10.1063/5.0258483
The impact of hydration shell inclusion and chain exclusion in the efficacy of reaction coordinates for homogeneous and heterogeneous ice nucleation
In Special Collection:
Molecular Dynamics, Methods and Applications 60 Years after Rahman
J. Chem. Phys. 162, 164102 (2025)
https://doi.org/10.1063/5.0263587
Complete exciton Hamiltonian for photosynthetic pigment–protein complexes
In Special Collection:
David Jonas Festschrift
J. Chem. Phys. 162, 164109 (2025)
https://doi.org/10.1063/5.0258368
Correlations of density and current fluctuations in single-file motion of hard spheres and in driven lattice gas with nearest-neighbor interaction
In Special Collection:
Festschrift for Abraham Nitzan
J. Chem. Phys. 162, 164110 (2025)
https://doi.org/10.1063/5.0266744
Advanced Experimental Techniques
Probing exciton diffusion dynamics in photosynthetic supercomplexes via exciton–exciton annihilation
In Special Collection:
David Jonas Festschrift
J. Chem. Phys. 162, 164201 (2025)
https://doi.org/10.1063/5.0251771
Atoms, Molecules, and Clusters
Li4F4−: Planar tetracoordinate fluorine in a highly viable binary mono-anionic cluster
J. Chem. Phys. 162, 164301 (2025)
https://doi.org/10.1063/5.0259060
Hydrogen scrambling and high propensity for multiple neutral emissions from 1,3-butadiene dication
J. Chem. Phys. 162, 164302 (2025)
https://doi.org/10.1063/5.0244970
Selective formation and spectroscopic characterization of the H2CCS•+ radical cation via dissociative ionization of thiophene
Jake A. Diprose; Kim Steenbakkers; Matteo Michielan; Miroslav Polášek; Daniela Ascenzi; Sandra Brünken; Claire Romanzin; Brianna R. Heazlewood; Vincent Richardson
J. Chem. Phys. 162, 164304 (2025)
https://doi.org/10.1063/5.0260839
Electron–electron repulsion in carbazole oligomer-attached tris (2,4,6-trichlorophenyl) methyl radicals
In Special Collection:
Dynamic Exciton for Materials, Biology and Energy Conversion
Kenshiro Matsuda; Wataru Ota; Keiko Yamaoka; Kosuke Anraku; Emiko Fujiwara; Kazuhiro Nakamura; Takuya Hosokai; Tohru Sato; Ken Albrecht
J. Chem. Phys. 162, 164305 (2025)
https://doi.org/10.1063/5.0252492
Quantum stereodynamical control of charge transfer in low-temperature H+ + NO (v = 0, j = 2) collisions
J. Chem. Phys. 162, 164306 (2025)
https://doi.org/10.1063/5.0266072
Cold collisions of highly vibrationally excited and aligned D2 with Ne
J. Chem. Phys. 162, 164307 (2025)
https://doi.org/10.1063/5.0266360
Double aromaticity in the triplet ground state of Be2©Be6H6: A 4π Baird and 6σ Hückel electron system
J. Chem. Phys. 162, 164308 (2025)
https://doi.org/10.1063/5.0260532
Conformational equilibrium of aminoethanol in the gas phase and in solution driven by intra- and intermolecular interactions and solvent polarity
In Special Collection:
Festschrift for Abraham Nitzan
J. Chem. Phys. 162, 164309 (2025)
https://doi.org/10.1063/5.0259801
Correlated vibrational coherence and spectral diffusion analysis of multi-level systems using two-dimensional electronic spectroscopy
In Special Collection:
David Jonas Festschrift
J. Chem. Phys. 162, 164311 (2025)
https://doi.org/10.1063/5.0268218
Excited triplet state zero-field splitting in a ligand-to-ligand charge transfer complex
In Special Collection:
Dynamic Exciton for Materials, Biology and Energy Conversion
Joshua Mengell; Shiyue Gao; Caroline Mangione; Mundendra Yadav; Dominic Kersi; Jing Yang; Stephen McGill; David A. Shultz; Martin L. Kirk
J. Chem. Phys. 162, 164312 (2025)
https://doi.org/10.1063/5.0270046
Liquids, Glasses, and Crystals
Structure of liquids from reference hard body fluids: Additive vs non-additive hard body models
J. Chem. Phys. 162, 164505 (2025)
https://doi.org/10.1063/5.0253528
Materials, Surfaces, and Interfaces
Breakdown of broken-symmetry approach to exchange interaction
J. Chem. Phys. 162, 164701 (2025)
https://doi.org/10.1063/5.0255897
Novel rare-earth doped Cs2NaGdCl6:Sb3+ double perovskite nanocrystals toward good ability of color tuning with high quantum efficiency
Mingjie Dan; Yi Yu; Xiurong Zhu; Yingying Wang; Zishan Li; Mei Lai; Huan Ye; Yixin Fu; Wang Zhao; Kenneth R. Poeppelmeier
J. Chem. Phys. 162, 164702 (2025)
https://doi.org/10.1063/5.0265724
Polymers and Soft Matter
Thermodynamics for reduced models of polymer aggregation based on maximum entropy principle
J. Chem. Phys. 162, 164901 (2025)
https://doi.org/10.1063/5.0252088
Single-file diffusion of active Brownian particles
In Special Collection:
2024 JCP Emerging Investigators Special Collection
J. Chem. Phys. 162, 164902 (2025)
https://doi.org/10.1063/5.0248772
Thermodynamic insights into polyelectrolyte complexation: A theoretical framework
In Special Collection:
2024 JCP Emerging Investigators Special Collection
J. Chem. Phys. 162, 164904 (2025)
https://doi.org/10.1063/5.0250546
Biological Molecules and Networks
Exploring the high sensitivity of DFT thermochemistry for protonation states of a ferredoxin model complex
J. Chem. Phys. 162, 165101 (2025)
https://doi.org/10.1063/5.0261086
Deciphering ultrafast structural dynamics of the red Kaede chromophore in solution and a photoconvertible fluorescent protein
In Special Collection:
David Jonas Festschrift
J. Chem. Phys. 162, 165103 (2025)
https://doi.org/10.1063/5.0268655
LETTERS TO THE EDITOR
Notes
Errata
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