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The Journal of Chemical Physics is an international journal that publishes cutting edge research in all areas of modern physical chemistry and chemical physics. The Journal also publishes brief communications of significant new findings, perspectives on the latest advances in the field, and Special Topics.
Featured Articles
Research Article
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April 22 2025
Akinlade Akintunde, Parvin Bayati et al.
Single-file diffusion (SFD) is a key mechanism underlying transport phenomena in confined physical and biological systems. In a typical SFD process, microscopic particles are restricted to moving in ...
Research Article
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April 15 2025
Sandip Thakur, Ashutosh Giri
Owing to their unrivaled porosities and high surface areas, metal organic frameworks (MOFs) hold great promise for mitigating the global warming crisis through capturing and storing CO2 gas. However, ...
Research Article
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April 10 2025
Influence of quantum corrections on the predicted isobaric heat capacity of polarizable water models
Edoardo Savoia, Elton Oyarzua et al.
The isobaric heat capacity (Cp) is frequently used as a benchmark property whenever a new model is proposed or when comparing different force fields with classical molecular dynamics (MD) ...
Editor's Picks
Research Article
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April 01 2025
Willem Gispen, Peter G. Bolhuis et al.
Two-step crystallization via a metastable intermediate phase is often regarded as a non-classical process that lies beyond the framework of classical nucleation theory (CNT). In this work, we ...
Perspective
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April 01 2025
Han Lu, Huan Li et al.
Electrocatalysis is one of the key technologies for developing sustainable and fossil resource free routes to produce fuels and chemicals. The limiting potential (UL), defined by the reaction free ...
Article Commentary
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April 01 2025
Most Recent
Brief Report
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April 22 2025
Jamie D. Walls
In this Note, we reexamine an earlier alternative proposal for averaging NMR spectroscopic parameters in the fast-exchange regime [D. H. Jones, N. D. Kurur, and D. Pl Weitekamp, Bull. Magn. Reson. ...
Correction
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April 22 2025
Rapid Communication
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April 22 2025
Lorenzo Caprini, U. Marini Bettolo Marconi
We study a chiral system of particles subject to both odd interactions and standard repulsive interactions. The interplay between oddness and inertia induces a non-equilibrium phase transition from a ...
DeePMD-kit v2: A software package for deep potential models
Jinzhe Zeng, Duo Zhang, et al.
CREST—A program for the exploration of low-energy molecular chemical space
Philipp Pracht, Stefan Grimme, et al.