Tools for investigating electronic excitation: experiment and multi-scale modelling (original) (raw)

First-Principles Calculation of Electronic Excitations in Solids with SPEX

Ersoy Sasioglu

Zeitschrift für Physikalische Chemie, 2010

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First Principles Determination of Electronic Excitations Induced by Charged Particles

Jacek Jakowski

2019

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Electronic excitations in molecular solids: bridging theory and experiment

P. Raithby, Rachel Crespo-otero

Faraday Discuss., 2014

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Analysis of excitation energies and transition moments

Jens Oddershede

Journal of Physics B: …, 1978

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On the applicability of a few level rate equation model to the determination of exciton versus biexciton kinetics in quasi-zero-dimensional structures

Jan Misiewicz

Journal of Applied Physics, 2010

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Understanding Beam Induced Electronic Excitations in Materials

Jacek Jakowski

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Practical computation of electronic excitation in solution: vertical excitation model

Ciro A. Guido

Chem. Sci., 2011

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Effects of electronic excitations on potential energy surfaces: simple model calculations

Hiroki Tsuchiura

Surface Science, 1996

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Molecular electronic excitations calculated from a solid-state approach: Methodology and numerics

Friedhelm Bechstedt

Physical Review B, 2005

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Electronic Excitations in the Condensed Phase

Leonardo Bernasconi

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A second-order doubles correction to excitation energies in the random-phase approximation

Stephan P. A. Sauer

Chemical Physics Letters, 1998

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Theoretical Characterisation of the Electronic Excitation in Liquid Water

Andrea Amadei, Marco D'Abramo

ChemPhysChem, 2005

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Electronic excitations: density-functional versus many-body Green’s-function approaches

A. Rubio, Lucia Reining

Reviews of Modern Physics, 2002

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A basis set study for the calculation of electronic excitations using Monte Carlo configuration interaction

Michael Nolan

The Journal of Chemical Physics, 2001

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Systematic calculation of the surface excitation parameters for 22 materials

B DA

Surface and Interface Analysis, 2012

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The dynamics of highly excited electronic systems: Applications of the electron force field

Julius Su

The Journal of Chemical Physics, 2009

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First-principles calculations of electronic excitations in clusters

O. Pulci, Maurizia Palummo

International Journal of Quantum Chemistry, 2000

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On the dynamical content of excitation functions: Simple linearization procedures

Michael Menzinger

Chemical Physics, 1977

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First Principles Studies of Electronic and Optical Excitations in Noble Metal and Titania Clusters

Kopinjol Baishya

2013

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Rigorous simulations of emitting and non-emitting nano

Olaf Janssen

2010

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EXCITON PERCOLATION KINETICS AND EXClTON COHERENCY: 1 B,, NAPHTHALENE

Panos Argyrakis

1979

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Radiation effects from first principles : the role of excitons in electronic-excited processes

Bryan M Wong

2009

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Probing electronic excitations in molecular conduction

Avik Ghosh

Physical Review B, 2006

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Electronic excitations in solids: Density functional and Green’s function theory

Francesco Sottile

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Dynamics and Optical Absorption of Electronic Excitations Under the Influence of Coloured Noise

Volker Kraus

Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals, 1992

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The Effect of the Exciton Continuum on the Exciton–Exciton Correlation

Raffaello Girlanda

PHYSICA STATUS SOLIDI A …, 2000

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Electronic excitations in long polyenes revisited

paul tavan

The Journal of Chemical Physics, 2012

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Exciton Multiplication from First Principles

Oleg Victor Prezhdo

Accounts of Chemical Research, 2013

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Electronic Excitations in Complex Molecular Environments: Many-Body Green's Functions Theory in VOTCA-XTP

Björn Baumeier

Journal of Chemical Theory and Computation

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Assessment of quantum chemical methods and basis sets for excitation energy transfer

Reinhold Fink

Chemical Physics, 2008

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Final Report on ECCS/NSF Workshop on Quantum, Molecular and HighPerformance Modeling and Simulation for Devices and Systems (QMHP)

Paul Werbos

2007

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