First-principles theoretical study of organic/metal interfaces: Vacuum level shifts and interface dipoles

Current Applied Physics ◽

10.1016/j.cap.2012.06.021 ◽

2012 ◽

Vol 12 ◽

pp. S2-S9 ◽

Cited By ~ 14

Author(s):

Yoshitada Morikawa ◽

Kenji Toyoda ◽

Ikutaro Hamada ◽

Susumu Yanagisawa ◽

Kyuho Lee

Keyword(s):

First Principles ◽

Theoretical Study ◽

Organic Metal ◽

Vacuum Level ◽

Level Shifts ◽

Metal Interfaces

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Density functional theoretical study of pentacene/noble metal interfaces with van der Waals corrections: Vacuum level shifts and electronic structures

The Journal of Chemical Physics ◽

10.1063/1.3373389 ◽

2010 ◽

Vol 132 (13) ◽

pp. 134703 ◽

Cited By ~ 104

Author(s):

Kenji Toyoda ◽

Ikutaro Hamada ◽

Kyuho Lee ◽

Susumu Yanagisawa ◽

Yoshitada Morikawa

Keyword(s):

Noble Metal ◽

Electronic Structures ◽

Density Functional ◽

Theoretical Study ◽

Van Der Waals ◽

Vacuum Level ◽

Level Shifts ◽

Metal Interfaces

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First-principles Theoretical Study of Organic-metal Interfaces

Hyomen Kagaku ◽

10.1380/jsssj.32.9 ◽

2011 ◽

Vol 32 (1) ◽

pp. 9-14

Author(s):

Yoshitada MORIKAWA ◽

Susumu YANAGISAWA

Keyword(s):

First Principles ◽

Theoretical Study ◽

Organic Metal ◽

Metal Interfaces

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Density Functional Theoretical Study of Perfluoropentacene/Noble Metal Interfaces with van der Waals Corrections: Adsorption States and Vacuum Level Shifts

The Journal of Physical Chemistry C ◽

10.1021/jp1107262 ◽

2011 ◽

Vol 115 (13) ◽

pp. 5767-5772 ◽

Cited By ~ 22

Author(s):

Kenji Toyoda ◽

Ikutaro Hamada ◽

Kyuho Lee ◽

Susumu Yanagisawa ◽

Yoshitada Morikawa

Keyword(s):

Noble Metal ◽

Density Functional ◽

Theoretical Study ◽

Van Der Waals ◽

Vacuum Level ◽

Level Shifts ◽

Metal Interfaces

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Organic/metal interfaces in self-assembled monolayers of conjugated thiols: A first-principles benchmark study

Surface Science ◽

10.1016/j.susc.2006.07.023 ◽

2006 ◽

Vol 600 (19) ◽

pp. 4548-4562 ◽

Cited By ~ 103

Author(s):

Georg Heimel ◽

Lorenz Romaner ◽

Jean-Luc Brédas ◽

Egbert Zojer

Keyword(s):

First Principles ◽

Self Assembled Monolayers ◽

Organic Metal ◽

Benchmark Study ◽

Assembled Monolayers ◽

Metal Interfaces ◽

Self Assembled

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Density-functional theoretical study of fluorination effect on organic/metal interfaces

Organic Electronics ◽

10.1016/j.orgel.2010.11.010 ◽

2011 ◽

Vol 12 (2) ◽

pp. 295-299 ◽

Cited By ~ 11

Author(s):

Kenji Toyoda ◽

Ikutaro Hamada ◽

Susumu Yanagisawa ◽

Yoshitada Morikawa

Keyword(s):

Density Functional ◽

Theoretical Study ◽

Organic Metal ◽

Metal Interfaces

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Energy level alignment at organic/metal interfaces studied by UV photoemission: breakdown of traditional assumption of a common vacuum level at the interface

IEEE Transactions on Electron Devices ◽

10.1109/16.605471 ◽

1997 ◽

Vol 44 (8) ◽

pp. 1295-1301 ◽

Cited By ~ 168

Author(s):

H. Ishii ◽

K. Seki

Keyword(s):

Energy Level ◽

Organic Metal ◽

Vacuum Level ◽

Energy Level Alignment ◽

Traditional Assumption ◽

Metal Interfaces

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First-principles study of benzene on noble metal surfaces: Adsorption states and vacuum level shifts

Surface Science ◽

10.1016/j.susc.2009.07.039 ◽

2009 ◽

Vol 603 (18) ◽

pp. 2912-2922 ◽

Cited By ~ 74

Author(s):

Kenji Toyoda ◽

Yosuke Nakano ◽

Ikutaro Hamada ◽

Kyuho Lee ◽

Susumu Yanagisawa ◽

...

Keyword(s):

Noble Metal ◽

First Principles ◽

Metal Surfaces ◽

Vacuum Level ◽

First Principles Study ◽

Level Shifts

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Gap states at organic–metal interfaces: A combined spectroscopic and theoretical study

Applied Surface Science ◽

10.1016/j.apsusc.2010.01.063 ◽

2010 ◽

Vol 256 (13) ◽

pp. 4054-4064 ◽

Cited By ~ 11

Author(s):

Shigeru Masuda

Keyword(s):

Theoretical Study ◽

Organic Metal ◽

Metal Interfaces ◽

Gap States

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First-principles study of the pentacene/Cu(111) interface: Adsorption states and vacuum level shifts

Journal of Electron Spectroscopy and Related Phenomena ◽

10.1016/j.elspec.2009.04.005 ◽

2009 ◽

Vol 174 (1-3) ◽

pp. 78-84 ◽

Cited By ~ 36

Author(s):

Kenji Toyoda ◽

Yosuke Nakano ◽

Ikutaro Hamada ◽

Kyuho Lee ◽

Susumu Yanagisawa ◽

...

Keyword(s):

First Principles ◽

Vacuum Level ◽

First Principles Study ◽

Level Shifts

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First-principles insights into the electronic and magnetic structure of hybrid organic-metal interfaces

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/26/26/263001 ◽

2014 ◽

Vol 26 (26) ◽

pp. 263001 ◽

Cited By ~ 8

Author(s):

Predrag Lazić ◽

Vasile Caciuc ◽

Nicolae Atodiresei ◽

Martin Callsen ◽

Stefan Blügel

Keyword(s):

Magnetic Structure ◽

First Principles ◽

Organic Metal ◽

Electronic And Magnetic Structure ◽

Metal Interfaces

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