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A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments. / Rinkevicius, Zilvinas; Li, Xin; Sandberg, Jaime A.R.; Mikkelsen, Kurt Valentin; Agren, Hans.
I:
Journal of Chemical Theory and Computation, Bind 10, Nr. 3, 2014, s. 989-1003.
Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning › fagfællebedømt
Harvard
Rinkevicius, Z, Li, X, Sandberg, JAR
, Mikkelsen, KV & Agren, H 2014, '
A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments',
Journal of Chemical Theory and Computation, bind 10, nr. 3, s. 989-1003.
https://doi.org/10.1021/ct400897sAPA
Rinkevicius, Z., Li, X., Sandberg, J. A. R.
, Mikkelsen, K. V., & Agren, H. (2014).
A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments.
Journal of Chemical Theory and Computation,
10(3), 989-1003.
https://doi.org/10.1021/ct400897sVancouver
Rinkevicius Z, Li X, Sandberg JAR
, Mikkelsen KV, Agren H.
A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments.
Journal of Chemical Theory and Computation. 2014;10(3):989-1003.
https://doi.org/10.1021/ct400897sAuthor
Rinkevicius, Zilvinas ; Li, Xin ; Sandberg, Jaime A.R. ; Mikkelsen, Kurt Valentin ; Agren, Hans. / A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments. I: Journal of Chemical Theory and Computation. 2014 ; Bind 10, Nr. 3. s. 989-1003.
Bibtex
@article{ce0e1bf9c26c4573b7bc5aefb5977f54,
title = "A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments",
author = "Zilvinas Rinkevicius and Xin Li and Sandberg, {Jaime A.R.} and Mikkelsen, {Kurt Valentin} and Hans Agren",
year = "2014",
doi = "10.1021/ct400897s",
language = "English",
volume = "10",
pages = "989--1003",
journal = "Journal of Chemical Theory and Computation",
issn = "1549-9618",
publisher = "American Chemical Society",
number = "3",
}
RIS
TY - JOUR
T1 - A hybrid density functional theory/molecular mechanics approach for linear response properties in heterogeneous environments
AU - Rinkevicius, Zilvinas
AU - Li, Xin
AU - Sandberg, Jaime A.R.
AU - Mikkelsen, Kurt Valentin
AU - Agren, Hans
PY - 2014
Y1 - 2014
U2 - 10.1021/ct400897s
DO - 10.1021/ct400897s
M3 - Journal article
C2 - 26580178
VL - 10
SP - 989
EP - 1003
JO - Journal of Chemical Theory and Computation
JF - Journal of Chemical Theory and Computation
SN - 1549-9618
IS - 3
ER -
