Standard
Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide. / Kjær, Hanna; Sauer, Stephan P. A.; Kongsted, Jacob.
In:
Journal of Chemical Physics, Vol. 134, No. 4, 25.01.2011, p. 044514.
Research output: Contribution to journal › Journal article › Research › peer-review
Harvard
Kjær, H
, Sauer, SPA & Kongsted, J 2011, '
Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide',
Journal of Chemical Physics, vol. 134, no. 4, pp. 044514.
https://doi.org/10.1063/1.3546033
APA
Kjær, H.
, Sauer, S. P. A., & Kongsted, J. (2011).
Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide.
Journal of Chemical Physics,
134(4), 044514.
https://doi.org/10.1063/1.3546033
Vancouver
Kjær H
, Sauer SPA, Kongsted J.
Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide.
Journal of Chemical Physics. 2011 Jan 25;134(4):044514.
https://doi.org/10.1063/1.3546033
Author
Kjær, Hanna ; Sauer, Stephan P. A. ; Kongsted, Jacob. / Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide. In: Journal of Chemical Physics. 2011 ; Vol. 134, No. 4. pp. 044514.
Bibtex
@article{69fe266fb8b64b888faea89c95f71a29,
title = "Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide",
keywords = "Faculty of Science",
author = "Hanna Kj{\ae}r and Sauer, {Stephan P. A.} and Jacob Kongsted",
year = "2011",
month = jan,
day = "25",
doi = "10.1063/1.3546033",
language = "English",
volume = "134",
pages = "044514",
journal = "The Journal of Chemical Physics",
issn = "0021-9606",
publisher = "American Institute of Physics",
number = "4",
}
RIS
TY - JOUR
T1 - Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide
AU - Kjær, Hanna
AU - Sauer, Stephan P. A.
AU - Kongsted, Jacob
PY - 2011/1/25
Y1 - 2011/1/25
KW - Faculty of Science
U2 - 10.1063/1.3546033
DO - 10.1063/1.3546033
M3 - Journal article
C2 - 21280755
VL - 134
SP - 044514
JO - The Journal of Chemical Physics
JF - The Journal of Chemical Physics
SN - 0021-9606
IS - 4
ER -