State of the Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More, Volume 79 in the Advances in Quantum Chemistry series, presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology. Chapters in this new release include Computing accurate molecular properties in real space using multiresolution analysis, Self-consistent electron-nucleus cusp correction for molecular orbitals, Correlated methods for computational spectroscopy, Potential energy curves for the NaH molecule and its cation with the cock space coupled cluster method, and much more.
Название: Cross-Relaxation and Cross-Correlation Parameters in NMR: Molecular ApproachesISBN: 1849739137 ISBN-13(EAN): 9781849739139 Издательство: Royal Society of ChemistryРейтинг: Цена: 25186.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.Описание: This work will provide a detailed account of cross-relaxation and cross-correlation which would be timely and fill a gap in the present NMR literature for the analytical scientist.