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• W2615203862 abstract "Various methods for simulating materials and minerals at an atomic level are reviewed, including lattice energy relaxation, lattice dynamics, molecular dynamics and Monte Carlo methods, and including also the use of empirical interatomic potentials and ab-initio quantum mechanical methods. A small number of diverse applications are described. Approaches to job and data management are also discussed." @default.
• W2615203862 created "2017-05-26" @default.
• W2615203862 creator A5038174341 @default.
• W2615203862 date "2008-01-01" @default.
• W2615203862 modified "2023-09-28" @default.
• W2615203862 title "An introduction to atomistic simulation methods" @default.
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• W2615203862 hasPublicationYear "2008" @default.
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