Chemical shift driven geometry optimization

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Updated: Aug 14, 2026

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
12:11

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry

Published on: April 8, 2020

Raiker Witter1, Wolfram Priess, Ulrich Sternberg

  • 1PAF/IOQ/HF, Friedrich Schiller University Jena, Germany. witter@ioq.uni-jena.de

Journal of Computational Chemistry
|April 2, 2002
PubMed

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