A DFT/ZORA Study of Cadmium Magnetic Shielding Tensors: Analysis of Relativistic Effects and Electronic-State Approximations

Theoretical studies of the temperature dependence of magnetic shielding tensors: H2, HF, and LiH

Chemical Physics ◽

10.1016/0301-0104(81)80320-5 ◽

1981 ◽

Vol 63 (1-2) ◽

pp. 185-202 ◽

Cited By ~ 51

Author(s):

Robert Ditchfield

Keyword(s):

Temperature Dependence ◽

Magnetic Shielding ◽

Theoretical Studies ◽

Shielding Tensors

Relativistic effects on the nuclear magnetic shielding in theMF(M=Cu, Ag, Au) series

Physical Review A ◽

10.1103/physreva.76.052511 ◽

2007 ◽

Vol 76 (5) ◽

Cited By ~ 12

Author(s):

Jorge David ◽

Albeiro Restrepo

Keyword(s):

Relativistic Effects ◽

Magnetic Shielding ◽

The1H and13C Magnetic Shielding Tensors of Ethylene-1,2-13C Determined by NMR of the Oriented Molecule

Israel Journal of Chemistry ◽

10.1002/ijch.198300039 ◽

1983 ◽

Vol 23 (3) ◽

pp. 265-267

Author(s):

P. Diehl ◽

F. Moia

Keyword(s):

Magnetic Shielding ◽

Shielding Tensors ◽

Oriented Molecule

Theoretical calculations of the nuclear magnetic shielding tensors for the ethylenic carbon atoms in cyclopropenes

Molecular Physics ◽

10.1080/00268979200102501 ◽

1992 ◽

Vol 77 (2) ◽

pp. 381-396 ◽

Cited By ~ 22

Author(s):

Colin M. Smith ◽

Roger D. Amos ◽

Nicholas C. Handy

Keyword(s):

Theoretical Calculations ◽

Magnetic Shielding ◽

Ethylenic Carbon ◽

Shielding Tensors ◽

Nuclear Magnetic Shielding Tensors in Phosphorus Containing Ring Systems. A Theoretical Study

Phosphorus Sulfur and Silicon and the Related Elements ◽

10.1080/10426509408021820 ◽

1994 ◽

Vol 93 (1-4) ◽

pp. 217-220 ◽

Cited By ~ 1

Author(s):

U. Fleischer ◽

K. Krüger ◽

G. Grossmann ◽

W. Kutzelnigg

Keyword(s):

Theoretical Study ◽

Magnetic Shielding ◽

Ring Systems ◽

Phosphorus Containing ◽

Shielding Tensors ◽

Current density maps, magnetizability, and nuclear magnetic shielding tensors of bis-heteropentalenes. III. Thieno-thiophene isomers

Molecular Physics ◽

10.1080/00268970512331340574 ◽

2005 ◽

Vol 103 (6-8) ◽

pp. 789-801 ◽

Cited By ~ 9

Author(s):

I. García Cuesta ◽

R. Soriano Jartín ◽

A. Sánchez de Merás ◽

P. Lazzeretti *

Keyword(s):

Current Density ◽

Magnetic Shielding ◽

Density Maps ◽

Shielding Tensors ◽

Nitrogen-15 nuclear magnetic shielding tensors in nitrite and nitrate ion. Experimental and theoretical determinations

Chemical Physics Letters ◽

10.1016/0009-2614(94)00111-1 ◽

1994 ◽

Vol 219 (5-6) ◽

pp. 491-496 ◽

Cited By ~ 13

Author(s):

Patrick J. Barrie ◽

Christopher J. Groombridge ◽

Joan Mason ◽

Elaine A. Moore

Keyword(s):

Magnetic Shielding ◽

Nitrate Ion ◽

Shielding Tensors ◽

QM/MM calculation of protein magnetic shielding tensors with generalized hybrid-orbital method: A GIAO approach

Physical Chemistry Chemical Physics ◽

10.1039/c1cp21001g ◽

2011 ◽

Vol 13 (32) ◽

pp. 14490 ◽

Cited By ~ 3

Author(s):

Yoshinobu Akinaga ◽

Jaewoon Jung ◽

Seiichiro Ten-no

Keyword(s):

Magnetic Shielding ◽

Orbital Method ◽

Hybrid Orbital ◽

Shielding Tensors

Structure, magnetizability, and nuclear magnetic shielding tensors of bis-heteropentalenes. IV. Dihydrophospholophosphole isomers

Journal of Computational Chemistry ◽

10.1002/jcc.20349 ◽

2005 ◽

Vol 27 (3) ◽

pp. 344-351 ◽

Cited By ~ 7

Author(s):

Inmaculada García Cuesta ◽

Alfredo M. J. Sánchez De Merás ◽

Paolo Lazzeretti

Keyword(s):

Magnetic Shielding ◽

Shielding Tensors ◽

Current density maps, magnetizability, and nuclear magnetic shielding tensors of bis-heteropentalenes. I. Di-hydro-pyrrolo–pyrrole isomers

The Journal of Chemical Physics ◽

10.1063/1.1599337 ◽

2003 ◽

Vol 119 (11) ◽

pp. 5518-5526 ◽

Cited By ~ 14

Author(s):

I. Garcı́a Cuesta ◽

R. Soriano Jartı́n ◽

A. Sánchez de Merás ◽

P. Lazzeretti

Keyword(s):

Current Density ◽

Magnetic Shielding ◽

Density Maps ◽

Shielding Tensors ◽