Polarizable Density Embedding: A New QM/QM/MM-Based Computational Strategy

Jógvan Magnus Haugaard Olsen, Casper Steinmann, Kenneth Ruud, Jacob Kongsted

Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning › peer review

Originalsprog	Udefineret/Ukendt
Tidsskrift	Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory
Vol/bind	119
Udgave nummer	21
Sider (fra-til)	5344-5355
Antal sider	12
ISSN	1089-5639
DOI	https://doi.org/10.1021/jp510138k
Status	Udgivet - 1 maj 2015
Udgivet eksternt	Ja

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title = "Polarizable Density Embedding: A New QM/QM/MM-Based Computational Strategy",

author = "Olsen, {J{\'o}gvan Magnus Haugaard} and Casper Steinmann and Kenneth Ruud and Jacob Kongsted",

year = "2015",

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Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning › peer review

TY - JOUR

T1 - Polarizable Density Embedding

T2 - A New QM/QM/MM-Based Computational Strategy

AU - Olsen, Jógvan Magnus Haugaard

AU - Steinmann, Casper

AU - Ruud, Kenneth

AU - Kongsted, Jacob

PY - 2015/5/1

Y1 - 2015/5/1

U2 - 10.1021/jp510138k

DO - 10.1021/jp510138k

M3 - Tidsskriftartikel

SN - 1089-5639

VL - 119

SP - 5344

EP - 5355

JO - Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory

JF - Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory

IS - 21

ER -