Lecture Notes on: Free-Energy Calculations

  • Frenkel D
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Abstract

Techniques to compute absolute free energies of classical many-body systems are discussed with special emphasis on those techniques that can be used to map the phase diagram of solids and liquids. Recent technical advances in the study of multi-component systems and...

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Frenkel, D. (1991). Lecture Notes on: Free-Energy Calculations. In Computer Simulation in Materials Science (pp. 85–117). Springer Netherlands. https://doi.org/10.1007/978-94-011-3546-7_5

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