Classical Density Functional Study on Interfacial Structure and Differential Capacitance of Ionic Liquids near Charged Surfaces

The Journal of Physical Chemistry C ◽

10.1021/jp504001u ◽

2014 ◽

Vol 118 (29) ◽

pp. 15825-15834 ◽

Author(s):

Ke Ma ◽

Clifford E. Woodward ◽

Jan Forsman

Keyword(s):

Ionic Liquids ◽

Density Functional ◽

Differential Capacitance ◽

Interfacial Structure ◽

Functional Study ◽

Density Functional Study ◽

Charged Surfaces

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Molecular interactions and normal vibrations of Fe–bis(trifluoromethanesulfonyl)imide and 1-ethyl-3-methylimidazolium–Fe–bis(trifluoromethanesulfonyl)imide ionic liquids: A density functional study

Journal of Molecular Structure THEOCHEM ◽

10.1016/j.theochem.2009.04.009 ◽

2009 ◽

Vol 906 (1-3) ◽

pp. 78-82 ◽

Author(s):

Nilesh R. Dhumal ◽

Krishnan Damodaran

Keyword(s):

Ionic Liquids ◽

Molecular Interactions ◽

Density Functional ◽

Functional Study ◽

Normal Vibrations ◽

Density Functional Study

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Density functional study of the mechanism of nitric oxide captured by [Emim][OTf] ionic liquids

Advanced Materials and Energy Sustainability ◽

10.1142/9789813220393_0020 ◽

2017 ◽

Author(s):

Jia-Yao Huang ◽

Ai-Ping Fu ◽

Hong-Liang Li ◽

Shuai Zhang ◽

Hao Li ◽

...

Keyword(s):

Nitric Oxide ◽

Ionic Liquids ◽

Density Functional ◽

Functional Study ◽

Density Functional Study

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Probing anion–cellulose interactions in imidazolium-based room temperature ionic liquids: a density functional study

Carbohydrate Research ◽

10.1016/j.carres.2010.07.036 ◽

2010 ◽

Vol 345 (15) ◽

pp. 2201-2205 ◽

Author(s):

Jinxin Guo ◽

Dongju Zhang ◽

Chonggang Duan ◽

Chengbu Liu

Keyword(s):

Ionic Liquids ◽

Density Functional ◽

Room Temperature ◽

Functional Study ◽

Room Temperature Ionic Liquids ◽

Density Functional Study

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A Classical Density Functional Study of Clustering in Ionic Liquids at Electrified Interfaces

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.6b11491 ◽

2017 ◽

Vol 121 (3) ◽

pp. 1742-1751 ◽

Author(s):

Ke Ma ◽

Jan Forsman ◽

Clifford E. Woodward

Keyword(s):

Ionic Liquids ◽

Density Functional ◽

Functional Study ◽

Density Functional Study ◽

Electrified Interfaces

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Combinedab initio and density functional study of ring chain tautomerism in benzofurazan-1-oxide

Journal of Computational Chemistry ◽

10.1002/jcc.5 ◽

1996 ◽

Vol 17 (16) ◽

pp. 1848-1856 ◽

Author(s):

Guntram Rauhut

Keyword(s):

Density Functional ◽

Functional Study ◽

Density Functional Study

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Density Functional Study of the First-Row Transition-Metal Monoxides*

Zeitschrift für Physikalische Chemie ◽

10.1524/zpch.1996.1.1.039 ◽

1996 ◽

Vol 1 (1) ◽

pp. 39-49

Author(s):

J. Piechota ◽

M. Suffczyński

Keyword(s):

Transition Metal ◽

Density Functional ◽

Functional Study ◽

Density Functional Study

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Predicted structures and electronic properties of gallium-indium clusters GamInn–m (n = 4, 6, 8 and m < n): A density functional study

Журнал структурной химии ◽

10.26902/jsc20180501 ◽

2018 ◽

Vol 59 (5) ◽

Keyword(s):

Electronic Properties ◽

Density Functional ◽

Functional Study ◽

Density Functional Study

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Electronic structure of oxide, peroxide, and superoxide clusters of the 3d elements: A comparative density functional study

The Journal of Chemical Physics ◽

10.1063/1.2831583 ◽

2008 ◽

Vol 128 (9) ◽

pp. 094307 ◽

Author(s):

Ellie L. Uzunova ◽

Hans Mikosch ◽

Georgi St. Nikolov

Keyword(s):

Electronic Structure ◽

Density Functional ◽

Functional Study ◽

Density Functional Study ◽

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Density functional study of non-isothermal hard sphere fluids

Molecular Physics ◽

10.1080/00268976.2021.1875077 ◽

2021 ◽

pp. e1875077

Author(s):

Wenhan Jia ◽

Isamu Kusaka

Keyword(s):

Hard Sphere ◽

Density Functional ◽

Functional Study ◽

Density Functional Study

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Charge transport properties in functionalized triphenylene and coronene derivatives: a density functional study using different functionals

Molecular Crystals and Liquid Crystals ◽

10.1080/15421406.2020.1870201 ◽

2021 ◽

pp. 1-15

Author(s):

Ziran Chen ◽

Yujin Zhang ◽

Yuan Li ◽

Wenhao Yu

Keyword(s):

Charge Transport ◽

Transport Properties ◽

Density Functional ◽

Functional Study ◽

Density Functional Study

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