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Entries: 1-10  
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Ionic liquids studied across different scales: A computational perspective
Authors: Wendler, K.; Dommert, F.; Zhao, Y. Y.; Berger, R.; Holm, Christian; Delle Site, Luigi
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Faraday Discussions
Volume: 154
Start Page: 111
End Page: 132
Document Type: Article
ID: 577422.0
Force Fields for Studying the Structure and Dynamics of Ionic Liquids: A Critical Review of Recent Developments
Authors: Dommert, F.; Wendler, K.; Berger, R.; Delle Site, Luigi; Holm, Christian
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: ChemPhysChem
Volume: 13
Issue / Number: 7
Start Page: 1625
End Page: 1637
Document Type: Article
ID: 610407.0
Locality and Fluctuations: Trends in Imidazolium-Based Ionic
Liquids and Beyond
Authors: Wendler, K.; Zahn, S.; Dommert, F.; Berger, R.; Holm, Christian; Kirchner, B.; Delle Site, Luigi
Date of Publication (YYYY-MM-DD): 2011
Title of Journal: Journal of Chemical Theory and Computation
Volume: 7
Issue / Number: 10
Start Page: 3040
End Page: 3044
Document Type: Article
ID: 573279.0
Electrostatic properties of liquid 1,3-dimethylimidazolium chloride: role of local polarization and effect of the bulk
Authors: Krekeler, C.; Dommert, F.; Schmidt, J.; Zhao, Y. Y.; Holm, Christian; Berger, R.; Delle Site, Luigi
Date of Publication (YYYY-MM-DD): 2010
Title of Journal: Physical Chemistry Chemical Physics
Volume: 12
Issue / Number: 8
Start Page: 1817
End Page: 1821
Document Type: Article
ID: 455168.0
Towards multiscale modeling of ionic liquids: From electronic structure to bulk properties
Authors: Dommert, F.; Schmidt, J.; Krekeler, C.; Zhao, Y. Y.; Berger, R.; Delle Site, Luigi; Holm, Christian
Date of Publication (YYYY-MM-DD): 2010
Title of Journal: Journal of Molecular Liquids
Volume: 152
Issue / Number: 1-3
Start Page: 2
End Page: 8
Document Type: Article
ID: 475679.0
Ionic Charge Reduction and Atomic Partial Charges from First-Principles Calculations of 1,3-Dimethylimidazolium Chloride
Authors: Schmidt, J.; Krekeler, C.; Dommert, F.; Zhao, Y. Y.; Berger, R.; Delle Site, Luigi; Holm, Christian
Date of Publication (YYYY-MM-DD): 2010
Title of Journal: Journal of Physical Chemistry B
Volume: 114
Issue / Number: 18
Start Page: 6150
End Page: 6155
Document Type: Article
ID: 476446.0
Effect of anions on static orientational correlations, hydrogen bonds, and dynamics in ionic liquids: A simulational study
Authors: Qiao, B.; Krekeler, C.; Berger, R.; Delle Site, Luigi; Holm, Christian
Date of Publication (YYYY-MM-DD): 2008
Title of Journal: Journal of Physical Chemistry B
Volume: 112
Issue / Number: 6
Start Page: 1743
End Page: 1751
Document Type: Article
ID: 336748.0
Study of 1,3-dimethylimidazolium chloride with electronic structure methods and force field approaches
Authors: Krekeler, C.; Schmidt, J.; Zhao, Y. Y.; Qiao, B. F.; Berger, R.; Holm, Christian; Delle Site, Luigi
Date of Publication (YYYY-MM-DD): 2008
Title of Journal: Journal of Chemical Physics
Volume: 129
Issue / Number: 17
Sequence Number of Article: 174503
Document Type: Article
ID: 398292.0
A comparative study of two classical force fields on statics and dynamics of [EMIM][BF4] investigated via molecular dynamics simulations
Authors: Dommert, F.; Schmidt, J.; Qiao, B. F.; Zhao, Y. Y.; Krekeler, C.; Delle Site, Luigi; Berger, R.; Holm, Christian
Date of Publication (YYYY-MM-DD): 2008
Title of Journal: Journal of Chemical Physics
Volume: 129
Issue / Number: 22
Sequence Number of Article: 224501
Document Type: Article
ID: 398825.0
Creatine protects the immature brain from hypoxic-ischemic injury
Authors: Berger, R.; Middelanis, J.; Vaihinger, H. M.; Mies, Günter; Wilken, B.; Jensen, A.
Date of Publication (YYYY-MM-DD): 2004-01
Title of Journal: Journal of the Society for Gynecologic Investigation
Volume: 11
Issue / Number: 1
Start Page: 9
End Page: 15
Document Type: Article
ID: 376270.0
Entries: 1-10  
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