SAGE MD: molecular-dynamic software package to study properties of materials with different models for interatomic interactions

The paper describes molecular-dynamic modules and the graphical user interface of the computer code––SAGE MD. Algorithms for numerical solution of equations of motion and approaches used in representing interatomic interaction potentials are described and discussed. A few representative cases were chosen to illustrate application of the code to the derivation of properties of materials with different types of chemical bonding.