The Potential of Mean Force concept for bridging (length and time) scales in the modeling of complex porous materials
We introduce the concept of Potential of Mean Force, PMF, as a way to implement upscaling modeling from the nano-scale to micron-scale. A PMF is a free energy function representing in an effective way the interactions between objects (cement hydrates, clay platelets, etc.) at thermodynamics conditio...
Main Authors: | Ioannidou Katerina, Carrier Benoit, Vandamme Matthieu, Pellenq Roland |
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Format: | Article |
Language: | English |
Published: |
EDP Sciences
2017-01-01
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Series: | EPJ Web of Conferences |
Online Access: | https://doi.org/10.1051/epjconf/201714001009 |
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