Work

On the calculation of second-order magnetic properties using subsystem approaches in a relativistic framework

Year: 2017

Type: article

Abstract: complex, and calls for a thorough comparison of ZORA and DC Hamiltonians in the description of environment effects on NMR parameters for molecular systems with heavy elements.

Source: Physical Chemistry Chemical Physics

DOI: 10.1039/c6cp08561j

Authors: Małgorzata Olejniczak, Radovan Bast, André Severo Pereira Gomes

Institutions: Centre National de la Recherche Scientifique, Université de Lille, Laboratoire de Physique des Lasers, Atomes et Molécules, UiT The Arctic University of Norway

Language: English

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: green

Funders: Agence Nationale de la Recherche, Ministère de l'Education Nationale, de l'Enseignement Superieur et de la Recherche, Centre National de la Recherche Scientifique

Awards: G1253922730, G2765205154, Physiques et Chimie de l'Environnement Atmosphérique

OpenAlex ID: W2592903204

FWCI: 1.603

Cites: 128

Cited by: 26

Related to: 10