Lattice, time-dependent Schrödinger equation approach for charge transfer in collisions of Be4+with atomic hydrogen

2006 ◽  
Vol 39 (12) ◽  
pp. 2877-2891 ◽  
Author(s):  
T Minami ◽  
M S Pindzola ◽  
T-G Lee ◽  
D R Schultz
Keyword(s):  
Charge Transfer ◽  
Schrödinger Equation ◽  
Atomic Hydrogen ◽  
Schrodinger Equation ◽  
Time Dependent ◽  
Equation Approach

Introduction

2018 ◽  
Author(s):  
Niels Engholm Henriksen ◽  
Flemming Yssing Hansen
Keyword(s):  
Schrödinger Equation ◽  
Schrodinger Equation ◽  
Degrees Of Freedom ◽  
State Level ◽  
Boltzmann Distribution ◽  
Theoretical Description ◽  
Time Dependent ◽  
Nuclear Dynamics ◽  
Molecular Reaction ◽  
Oppenheimer Approximation

This introductory chapter considers first the relation between molecular reaction dynamics and the major branches of physical chemistry. The concept of elementary chemical reactions at the quantized state-to-state level is discussed. The theoretical description of these reactions based on the time-dependent Schrödinger equation and the Born–Oppenheimer approximation is introduced and the resulting time-dependent Schrödinger equation describing the nuclear dynamics is discussed. The chapter concludes with a brief discussion of matter at thermal equilibrium, focusing at the Boltzmann distribution. Thus, the Boltzmann distribution for vibrational, rotational, and translational degrees of freedom is discussed and illustrated.

Numerical Solution of the Time-Dependent Schrödinger Equation and Application toH+-H

1979 ◽  
Vol 43 (7) ◽  
pp. 512-515 ◽  
Author(s):  
Vida Maruhn-Rezwani ◽  
Norbert Grün ◽  
Werner Scheid
Keyword(s):  
Schrödinger Equation ◽  
Numerical Solution ◽  
Schrodinger Equation ◽  
Time Dependent
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