Skip Nav Destination
Ultrafast dynamics of CN radical reactions with chloroform solvent under vibrational strong coupling
Issues
COMMUNICATIONS
The receding contact line cools down during dynamic wetting
J. Chem. Phys. 159, 161102 (2023)
https://doi.org/10.1063/5.0171769
Enthalpy-entropy compensation in the slow Arrhenius process
J. Chem. Phys. 159, 161103 (2023)
https://doi.org/10.1063/5.0174213
ARTICLES
Theoretical Methods and Algorithms
ACEpotentials.jl: A Julia implementation of the atomic cluster expansion
In Special Collection:
Software for Atomistic Machine Learning
William C. Witt; Cas van der Oord; Elena Gelžinytė; Teemu Järvinen; Andres Ross; James P. Darby; Cheuk Hin Ho; William J. Baldwin; Matthias Sachs; James Kermode; Noam Bernstein; Gábor Csányi; Christoph Ortner
J. Chem. Phys. 159, 164101 (2023)
https://doi.org/10.1063/5.0158783
Assessment of the partial saddle point approximation in field-theoretic polymer simulations
J. Chem. Phys. 159, 164103 (2023)
https://doi.org/10.1063/5.0173047
On analytical theories for conductivity and self-diffusion in concentrated electrolytes
In Special Collection:
2023 JCP Emerging Investigators Special Collection
J. Chem. Phys. 159, 164105 (2023)
https://doi.org/10.1063/5.0165533
Effect of fluid viscoelasticity, shear stress, and interface tension on the lift force in lubricated contacts
In Special Collection:
Adhesion and Friction
J. Chem. Phys. 159, 164106 (2023)
https://doi.org/10.1063/5.0173142
Driven transport of active particles through arrays of symmetric obstacles
J. Chem. Phys. 159, 164109 (2023)
https://doi.org/10.1063/5.0176523
Computational optimal transport for molecular spectra: The fully continuous case
J. Chem. Phys. 159, 164110 (2023)
https://doi.org/10.1063/5.0166469
Inferring free-energy barriers and kinetic rates from molecular dynamics via underdamped Langevin models
J. Chem. Phys. 159, 164111 (2023)
https://doi.org/10.1063/5.0169050
Orbital-free density-functional theory for metal slabs
In Special Collection:
John Perdew Festschrift
J. Chem. Phys. 159, 164112 (2023)
https://doi.org/10.1063/5.0169977
Locality error free effective core potentials for 3d transition metal elements developed for the diffusion Monte Carlo method
Tom Ichibha; Yutaka Nikaido; M. Chandler Bennett; Jaron T. Krogel; Kenta Hongo; Ryo Maezono; Fernando A. Reboredo
J. Chem. Phys. 159, 164114 (2023)
https://doi.org/10.1063/5.0175381
Gaussian attractive potential for carboxylate/cobalt surface interactions
J. Chem. Phys. 159, 164115 (2023)
https://doi.org/10.1063/5.0173351
Multicomponent solutions: Combining rules for multisolute osmotic virial coefficients
J. Chem. Phys. 159, 164116 (2023)
https://doi.org/10.1063/5.0166482
Advanced Experimental Techniques
A versatile platform for gas-phase molecular polaritonics
J. Chem. Phys. 159, 164202 (2023)
https://doi.org/10.1063/5.0170326
Atoms, Molecules, and Clusters
Ultrafast dynamics of CN radical reactions with chloroform solvent under vibrational strong coupling
In Special Collection:
JCP and CPR Editors’ Choice 2024
,
JCP Editors’ Choice 2023
,
2023 JCP Emerging Investigators Special Collection
J. Chem. Phys. 159, 164302 (2023)
https://doi.org/10.1063/5.0167410
Cryo IR spectroscopy and cryo kinetics of dinitrogen activation and cleavage by small tantalum cluster cations
Daniela V. Fries; Matthias P. Klein; Annika Straßner; Maximilian E. Huber; Maximilian Luczak; Christopher Wiehn; Gereon Niedner-Schatteburg
J. Chem. Phys. 159, 164303 (2023)
https://doi.org/10.1063/5.0157217
Exploring the parameter space of an endohedral atom in a cylindrical cavity
J. Chem. Phys. 159, 164308 (2023)
https://doi.org/10.1063/5.0170010
State-to-state rovibrational transition rates for CO2 in the bend mode in collisions with He atoms
J. Chem. Phys. 159, 164310 (2023)
https://doi.org/10.1063/5.0174787
Phenylpropiolic acid isolated in cryogenic nitrogen and xenon matrices: NIR and UV-induced study
J. Chem. Phys. 159, 164311 (2023)
https://doi.org/10.1063/5.0167128
Liquids, Glasses, and Crystals
Development of an analytical exponential-6 equation of state through Monte Carlo simulations
J. Chem. Phys. 159, 164501 (2023)
https://doi.org/10.1063/5.0171319
Charge transport in highly acidic glass-forming protic ionic liquids tailored by zwitterionic precursors
J. Chem. Phys. 159, 164503 (2023)
https://doi.org/10.1063/5.0165407
Materials, Surfaces, and Interfaces
Effect of wall free energy formulation on the wetting phenomenon: Conservative Allen–Cahn model
J. Chem. Phys. 159, 164701 (2023)
https://doi.org/10.1063/5.0168394
Sulfur-graded kesterite structured film drives improvement of VOC
J. Chem. Phys. 159, 164703 (2023)
https://doi.org/10.1063/5.0174239
Dynamic properties of photogenerated charge in BiOBr/Bi2WO6/GO ternary composites and its application for organic pollutants degradation
In Special Collection:
Carbon-based Materials for Energy Conversion and Storage
Tian Lang; Jiayan Yang; Yuanyuan Liu; Awen Jiang; Jing Wu; Jie Chen; Tengfeng Xie; Qingqing Qiu; Tongxiang Liang
J. Chem. Phys. 159, 164707 (2023)
https://doi.org/10.1063/5.0167021
Polymers and Soft Matter
Phase behavior of mixtures of hard colloids and soft coarse-grained macromolecules
J. Chem. Phys. 159, 164901 (2023)
https://doi.org/10.1063/5.0172527
Intrinsic viscosity and dielectric relaxation of ring polymers in dilute solutions
J. Chem. Phys. 159, 164902 (2023)
https://doi.org/10.1063/5.0169880
Dynamically and structurally heterogeneous 1-propanol/water mixtures
J. Chem. Phys. 159, 164903 (2023)
https://doi.org/10.1063/5.0170504
Diffusion and thermodiffusion of the ternary system polystyrene + toluene + cyclohexane
J. Chem. Phys. 159, 164904 (2023)
https://doi.org/10.1063/5.0176432
Biological Molecules and Networks
Origin of the nonlinear structural and mechanical properties in oppositely curved lipid mixtures
J. Chem. Phys. 159, 165102 (2023)
https://doi.org/10.1063/5.0167144
The Amsterdam Modeling Suite
Evert Jan Baerends, Nestor F. Aguirre, et al.
DeePMD-kit v2: A software package for deep potential models
Jinzhe Zeng, Duo Zhang, et al.
Light–matter interaction at the nano- and molecular scale
Kaifeng Wu, Chufeng Zhang, et al.