Studies of he heh and h2oh cn reactive scattering systems using multiconfiguration time dependent hartree approach

Abstract

Studies of quantum reactive scattering systems using the time dependent wave packet approach provides an opportunity to understand the underlying picture of the reaction dynamics The objective of this work is to carry out a molecular level analysis of the reaction dynamics of three different systems one tri atomic ion molecule system the He OH and H2 CN The quantum dynamics has been studied by propagating wave packets using the MCDTH algorithm The importance of inclusion of Coriolis cou