A Theoretical Approach to Molecular Single Electron Transistors

Stine T. Olsen; T. Hansen; Kurt Valentin Mikkelsen

A Theoretical Approach to Molecular Single Electron Transistors

Stine T. Olsen, T. Hansen, Kurt Valentin Mikkelsen

Department of Chemistry

7 Citations (Scopus)

Abstract

We present theoretical methods and computational strategies of the effects of nanoparticles on linear optical properties of molecules. We present quantum mechanical-molecular mechanics response methods for calculating electromagnetic properties of molecules interacting with nanoparticles and we report strategies for calculating electronic and redox states of molecules sandwiched between gold nanoparticles.

Original language	English
Journal	Theoretical Chemistry Accounts
Volume	130
Pages (from-to)	839-850
ISSN	1432-881X
Publication status	Published - Dec 2011

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title = "A Theoretical Approach to Molecular Single Electron Transistors",

abstract = "We present theoretical methods and computational strategies of the effects of nanoparticles on linear optical properties of molecules. We present quantum mechanical-molecular mechanics response methods for calculating electromagnetic properties of molecules interacting with nanoparticles and we report strategies for calculating electronic and redox states of molecules sandwiched between gold nanoparticles.",

author = "Olsen, {Stine T.} and T. Hansen and Mikkelsen, {Kurt Valentin}",

year = "2011",

month = dec,

language = "English",

volume = "130",

pages = "839--850",

journal = "Theoretical Chemistry Accounts",

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T1 - A Theoretical Approach to Molecular Single Electron Transistors

AU - Olsen, Stine T.

AU - Hansen, T.

AU - Mikkelsen, Kurt Valentin

PY - 2011/12

Y1 - 2011/12

N2 - We present theoretical methods and computational strategies of the effects of nanoparticles on linear optical properties of molecules. We present quantum mechanical-molecular mechanics response methods for calculating electromagnetic properties of molecules interacting with nanoparticles and we report strategies for calculating electronic and redox states of molecules sandwiched between gold nanoparticles.

AB - We present theoretical methods and computational strategies of the effects of nanoparticles on linear optical properties of molecules. We present quantum mechanical-molecular mechanics response methods for calculating electromagnetic properties of molecules interacting with nanoparticles and we report strategies for calculating electronic and redox states of molecules sandwiched between gold nanoparticles.

M3 - Journal article

SN - 1432-881X

VL - 130

SP - 839

EP - 850

JO - Theoretical Chemistry Accounts

JF - Theoretical Chemistry Accounts

ER -

A Theoretical Approach to Molecular Single Electron Transistors

Abstract

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