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Current Issue
Volume 161,
Issue 12,
28 September 2024

Focus and Coverage

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.

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Editor's Picks
Rapid Communication
Pablo Montero de Hijes, Christoph Dellago et al.
We investigate the density isobar of water and the melting temperature of ice using six different density functionals. Machine-learning potentials are employed to ensure computational affordability. ...
Research Article
Aojie Xue, Jiahao Xu et al.
Finite size scaling for a first order phase transition, where a continuous symmetry is broken, is tested using an approximation of Gaussian probability distributions with a phenomenological ...
Rapid Communication
Rinipal Kaur, Abigail Ladau et al.
Chemical and physical processes on the surfaces of amorphous solids have been the focus of many studies over the past decades. These studies have established that dynamics in a thin layer near a ...
Most Recent
Research Article
Riccardo Farris, Konstantin M. Neyman et al.
The energetically most favorable chemical ordering of bimetallic nanoparticles can be characterized by combining global optimization algorithms and surrogate energy models. The latter approximate the ...
Research Article
Michelle Richer, Gabriela Sánchez-Díaz et al.
PyCI is a free and open-source Python library for setting up and running arbitrary determinant-driven configuration interaction (CI) computations, as well as their generalizations to cases where the ...
Research Article
Katherine M. Kidder, W. G. Noid
Low-resolution coarse-grained (CG) models provide significant computational and conceptual advantages for simulating soft materials. However, the properties of CG models depend quite sensitively upon ...
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