Scholars@Duke publication: Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors

Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors

Publication , Journal Article

Facelli, JC; Orendt, AM; Grant, DM; Michl, J

Published in: Chemical Physics Letters

November 30, 1984

Calculations of the antisymmetric components of ¹³C shielding tensors have been performed in several compounds using the IGLO (individual gauge for localized orbitals) method. The results indicate chemical situations in which the detection of the antisymmetric components should be easier than in the cases analyzed by Iwai and Saika. © 1984.

Duke Scholars

Author Julio Cesar Facelli Biostatistics & Bioinformatics, Division of Translational Bi ...

Published In

Chemical Physics Letters

DOI

10.1016/0009-2614(84)85010-1

ISSN

0009-2614

Publication Date

November 30, 1984

Volume

112

Issue

Start / End Page

147 / 149

Related Subject Headings

Chemical Physics
51 Physical sciences
34 Chemical sciences
10 Technology
03 Chemical Sciences
02 Physical Sciences

Citation

APA

Chicago

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MLA

NLM

Facelli, J. C., Orendt, A. M., Grant, D. M., & Michl, J. (1984). Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors. Chemical Physics Letters, 112(2), 147–149. https://doi.org/10.1016/0009-2614(84)85010-1

Facelli, J. C., A. M. Orendt, D. M. Grant, and J. Michl. “Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors.” Chemical Physics Letters 112, no. 2 (November 30, 1984): 147–49. https://doi.org/10.1016/0009-2614(84)85010-1.

Facelli JC, Orendt AM, Grant DM, Michl J. Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors. Chemical Physics Letters. 1984 Nov 30;112(2):147–9.

Facelli, J. C., et al. “Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors.” Chemical Physics Letters, vol. 112, no. 2, Nov. 1984, pp. 147–49. Scopus, doi:10.1016/0009-2614(84)85010-1.

Facelli JC, Orendt AM, Grant DM, Michl J. Iglo calculations of the antisymmetric components of nuclear magnetic shielding tensors. Chemical Physics Letters. 1984 Nov 30;112(2):147–149.

Published In

Chemical Physics Letters

DOI

10.1016/0009-2614(84)85010-1

ISSN

0009-2614

Publication Date

November 30, 1984

Volume

112

Issue

Start / End Page

147 / 149

Related Subject Headings

Chemical Physics
51 Physical sciences
34 Chemical sciences
10 Technology
03 Chemical Sciences
02 Physical Sciences