Molecular Dynamics as a Mathematical Mapping. II. Partial Derivatives in the Microcanonical Ensemble

DOI10.1080/08927020108028292zbMath1017.81049OpenAlexW2061554089MaRDI QIDQ2752420

Jelena Stefanović, Constantinos C. Pantelides

Publication date: 19 August 2003

Published in: Molecular Simulation (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1080/08927020108028292

zbMATH Keywords

molecular dynamicsmathematical mappingNewton equations of motionpotential energy interaction

Mathematics Subject Classification ID

Molecular physics (81V55)

Cites Work

• Solving Ordinary Differential Equations I
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