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Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn. / Hedegård, Erik Donovan; Kongsted, Jacob; Sauer, Stephan P. A.
In:
Journal of Chemical Theory and Computation, Vol. 7, No. 12, 14.11.2011, p. 4077.
Research output: Contribution to journal › Journal article › Research › peer-review
Harvard
Hedegård, ED, Kongsted, J
& Sauer, SPA 2011, '
Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn',
Journal of Chemical Theory and Computation, vol. 7, no. 12, pp. 4077.
https://doi.org/10.1021/ct200587kAPA
Hedegård, E. D., Kongsted, J.
, & Sauer, S. P. A. (2011).
Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn.
Journal of Chemical Theory and Computation,
7(12), 4077.
https://doi.org/10.1021/ct200587kVancouver
Hedegård ED, Kongsted J
, Sauer SPA.
Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn.
Journal of Chemical Theory and Computation. 2011 Nov 14;7(12):4077.
https://doi.org/10.1021/ct200587kAuthor
Hedegård, Erik Donovan ; Kongsted, Jacob ; Sauer, Stephan P. A. / Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn. In: Journal of Chemical Theory and Computation. 2011 ; Vol. 7, No. 12. pp. 4077.
Bibtex
@article{fd0eaf56bd894366a29a72f35138de90,
title = "Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn",
author = "Hedeg{\aa}rd, {Erik Donovan} and Jacob Kongsted and Sauer, {Stephan P. A.}",
year = "2011",
month = nov,
day = "14",
doi = "10.1021/ct200587k",
language = "English",
volume = "7",
pages = "4077",
journal = "Journal of Chemical Theory and Computation",
issn = "1549-9618",
publisher = "American Chemical Society",
number = "12",
}
RIS
TY - JOUR
T1 - Optimized Basis sets for Calculation of Electron Paramagnetic Resonance Hyperfine Coupling Constants: aug-cc-pVTZ-J for the 3d atoms Sc–Zn
AU - Hedegård, Erik Donovan
AU - Kongsted, Jacob
AU - Sauer, Stephan P. A.
PY - 2011/11/14
Y1 - 2011/11/14
U2 - 10.1021/ct200587k
DO - 10.1021/ct200587k
M3 - Journal article
VL - 7
SP - 4077
JO - Journal of Chemical Theory and Computation
JF - Journal of Chemical Theory and Computation
SN - 1549-9618
IS - 12
ER -
