A Time-Dependent Born-Oppenheimer Approximation with Exponentially Small Error Estimates
Mathematical Physics
2009-10-31 v1 math.MP
Abstract
We present the construction of an exponentially accurate time-dependent Born-Oppenheimer approximation for molecular quantum mechanics. We study molecular systems whose electron masses are held fixed and whose nuclear masses are proportional to , where is a small expansion parameter. By optimal truncation of an asymptotic expansion, we construct approximate solutions to the time-dependent Schr\"odinger equation that agree with exact normalized solutions up to errors whose norms are bounded by , for some C and .
Cite
@article{arxiv.math-ph/0005006,
title = {A Time-Dependent Born-Oppenheimer Approximation with Exponentially Small Error Estimates},
author = {George A. Hagedorn and Alain Joye},
journal= {arXiv preprint arXiv:math-ph/0005006},
year = {2009}
}