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This is a path-integral based quantum dynamics method, known as Ring Polymer Molecular Dynamics (RPMD). This method can captures quantum effects and successfully describe the ground state Chemical reactivity. [Ian R. Craig and David E. Manolopoulos, JCP, 121, 3368 (2004)]
Sutirthachowdhury/Adiabatic_RPMD_method
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This is a path-integral based quantum dynamics method, known as Ring Polymer Molecular Dynamics (RPMD). This method can captures quantum effects and successfully describe the ground state Chemical reactivity. [Ian R. Craig and David E. Manolopoulos, JCP, 121, 3368 (2004)]
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