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portada Classical Statistical Mechanics with Nested Sampling

Classical Statistical Mechanics with Nested Sampling

Robert John Nicholas Baldock (Author) · Springer · Paperback

Classical Statistical Mechanics with Nested Sampling - Baldock, Robert John Nicholas

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Synopsis "Classical Statistical Mechanics with Nested Sampling"

Nominated as an outstanding PhD thesis by the University of Cambridge, UK Enables the calculation of partition functions as explicit functions of temperature for realistic models of materials directly from atomic interactions Allows the determination of complete phase diagrams and pressure-volume-temperature equations of state Illustrates the efficiency of the algorithm which paves the way for the automated calculation of phase diagrams

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