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Bond-controlled configurational entropy reduction in chemical vitrification
Nature, 2002Glass formation is usually viewed in terms of physical vitrification: a liquid in a metastable state is cooled or compressed so as to avoid crystallization. However, glasses may also be formed by chemical vitrification, a process involving progressive polymerization of the constituent molecules via the formation of irreversible chemical bonds.
COREZZI, Silvia +2 more
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The Classical Ideal Gas: configurational Entropy
2012This chapter derives the part of the entropy that is generated by the positions of particles, or the configurational entropy. The remaining part of the entropy, which is generated by the momenta of the particles, is derived in Chapter 6. While both derivations are unconventional, they are based directly on an 1877 paper by Boltzmann that discusses the ...
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Phys. Chem. Chem. Phys., 2012
One challenge in computational biophysics and biology is to develop methodologies able to estimate accurately the configurational entropy of macromolecules. Among many methods, the quasiharmonic approximation (QH) is most widely used as it is simple in both theory and implementation.
Nguyen, Phuong H., Derreumaux, Philippe
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One challenge in computational biophysics and biology is to develop methodologies able to estimate accurately the configurational entropy of macromolecules. Among many methods, the quasiharmonic approximation (QH) is most widely used as it is simple in both theory and implementation.
Nguyen, Phuong H., Derreumaux, Philippe
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Structural complexity and configurational entropy of crystals
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2016Using a statistical approach, it is demonstrated that the complexity of a crystal structure measured as the Shannon information per atom [Krivovichev (2012).Acta Cryst.A68, 393–398] represents a negative contribution to the configurational entropy of a crystalline solid.
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Configurational Entropy as Spatial Reach
This release reinterprets entropy not as statistical uncertainty, but as spatial reach of geometric configuration. Probability, reconstruction, and complexity emerge from curvature, symmetry, and topological indexing. This document completes a six-part series on geometric emergence: vacuum, space, quantum behavior, measurement, information, and entropy.Panasenko, Dmytro, Microsoft Copilot
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High-entropy electrolytes for practical lithium metal batteries
Nature Energy, 2023Sang Cheol Kim, Pu Zhang, Yuelang Chen
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Mechanical behavior of high-entropy alloys
Progress in Materials Science, 2021Dongyue Li, Yong Zhang, Yanfei Gao
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Engineering relaxors by entropy for high energy storage performance
Nature Energy, 2023, Hou-Bing Huang, Hao Pan
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