i-pi/i-pi: v3.1.12

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Authors

Michele Ceriotti

Yair Litman · Max Planck Institute for Polymer Research

Elia Stocco · Max Planck Institute for the Structure and Dynamics of Matter

Barak Hirshberg · Tel Aviv University

armaet

Abstract

Small bugfix release What's Changed Fix missing free ring-polymer step in nvt-cc by @venkatkapil24 in https://github.com/i-pi/i-pi/pull/521 Fix a nasty leaky pointer bug in plumed by @ceriottm in https://github.com/i-pi/i-pi/pull/522 Full Changelog: https://github.com/i-pi/i-pi/compare/v3.1.11...v3.1.12

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Published in: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.19328364

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i-pi/i-pi: v3.1.12

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Abstract

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Publication Details