𝔖 Bobbio Scriptorium
✦   LIBER   ✦

First Principles Calculations of Paramagnetic NMR Shifts

✍ Scribed by Seongho Moon; Serguei Patchkovskii


Publisher
John Wiley and Sons
Year
2005
Weight
8 KB
Volume
36
Category
Article
ISSN
0931-7597

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


First-principles calculation of paramete
✍ Eugene S. Kadantsev; Tom Ziegler πŸ“‚ Article πŸ“… 2010 πŸ› John Wiley and Sons 🌐 English βš– 220 KB

The hyperfine A-tensor and Zeeman g-tensor parameterize the interaction of an 'effective' electron spin with the magnetic field due to the nuclear spin and the homogeneous external magnetic field, respectively. The A-and g-tensors are the quantities of primary interest in electron paramagnetic reson

Laser-induced NMR shift of a paramagneti
✍ Li; Li; Chen; Dong-Ming; He; Tian-Jing; Wang; Xiu-Yan; Liu; Fan-Chen πŸ“‚ Article πŸ“… 2010 πŸ› John Wiley and Sons 🌐 English βš– 447 KB
First-principles calculations of electro
✍ Lucia Reining; Olivia Pulci; Maurizia Palummo; Giovanni Onida πŸ“‚ Article πŸ“… 2000 πŸ› John Wiley and Sons 🌐 English βš– 207 KB πŸ‘ 2 views

We discuss an approach to calculate electronic excitations in clusters, which starts from the determination of the ground state within density functional theory and the local density approximation, and subsequently yields electronic spectra from Green's function theory. These methods, which were ori