Anticorrelation between the Evolution of Molecular Dipole Moments and Induced Work Function Modifications

por Egger, David A., Zojer, Egbert
Publicado 2013

Dynamic shortening of disorder potentials in anharmonic halide perovskites

por Gehrmann, Christian, Egger, David A.
Publicado 2019

Impact of Anchoring Groups on Ballistic Transport: Single Molecule vs Monolayer Junctions

por Obersteiner, Veronika, Egger, David A., Zojer, Egbert
Publicado 2015

A Toolbox for Controlling the Energetics and Localization of Electronic States in Self‐Assembled Organic Monolayers

por Kretz, Bernhard, Egger, David A., Zojer, Egbert
Publicado 2015

Theory of Hydrogen Migration in Organic–Inorganic Halide Perovskites**

por Egger, David A, Kronik, Leeor, Rappe, Andrew M
Publicado 2015

Hybrid Organic–Inorganic Perovskites on the Move

por Egger, David A., Rappe, Andrew M., Kronik, Leeor
Publicado 2016

Transversal Halide Motion Intensifies Band‐To‐Band Transitions in Halide Perovskites

por Gehrmann, Christian, Caicedo‐Dávila, Sebastián, Zhu, Xiangzhou, Egger, David A.
Publicado 2022

The Electronic Structure of Mixed Self-Assembled Monolayers

por Rissner, Ferdinand, Egger, David A., Romaner, Lorenz, Heimel, Georg, Zojer, Egbert
Publicado 2010

Reliable Energy Level Alignment at Physisorbed Molecule–Metal Interfaces from Density Functional Theory

por Egger, David A., Liu, Zhen-Fei, Neaton, Jeffrey B., Kronik, Leeor
Publicado 2015

Dimensionality effects in the electronic structure of organic semiconductors consisting of polar repeat units

por Rissner, Ferdinand, Natan, Amir, Egger, David A., Hofmann, Oliver T., Kronik, Leeor, Zojer, Egbert
Publicado 2012

Collectively Induced Quantum-Confined Stark Effect in Monolayers of Molecules Consisting of Polar Repeating Units

por Rissner, Ferdinand, Egger, David A., Natan, Amir, Körzdörfer, Thomas, Kümmel, Stephan, Kronik, Leeor, Zojer, Egbert
Publicado 2011

Understanding Structure and Bonding of Multilayered Metal–Organic Nanostructures

por Egger, David A., Ruiz, Victor G., Saidi, Wissam A., Bučko, Tomáš, Tkatchenko, Alexandre, Zojer, Egbert
Publicado 2013

Adsorption Behavior of Nonplanar Phthalocyanines: Competition of Different Adsorption Conformations

por Wruss, Elisabeth, Hofmann, Oliver T., Egger, David A., Verwüster, Elisabeth, Gerlach, Alexander, Schreiber, Frank, Zojer, Egbert
Publicado 2016

Anharmonic Lattice Dynamics in Sodium Ion Conductors

por Brenner, Thomas M., Grumet, Manuel, Till, Paul, Asher, Maor, Zeier, Wolfgang G., Egger, David A., Yaffe, Omer
Publicado 2022

Transition voltages respond to synthetic reorientation of embedded dipoles in self-assembled monolayers

por Kovalchuk, Andrii, Abu-Husein, Tarek, Fracasso, Davide, Egger, David A., Zojer, Egbert, Zharnikov, Michael, Terfort, Andreas, Chiechi, Ryan C.
Publicado 2016

Effect of Molecule–Surface Reaction Mechanism on the Electronic Characteristics and Photovoltaic Performance of Molecularly Modified Si

por Yaffe, Omer, Ely, Tal, Har-Lavan, Rotem, Egger, David A., Johnston, Steve, Cohen, Hagai, Kronik, Leeor, Vilan, Ayelet, Cahen, David
Publicado 2013

Alloying Effects on Charge-Carrier Transport in Silver–Bismuth Double Perovskites

por Righetto, Marcello, Caicedo-Dávila, Sebastián, Sirtl, Maximilian T., Lim, Vincent J.-Y., Patel, Jay B., Egger, David A., Bein, Thomas, Herz, Laura M.
Publicado 2023

Understanding the Adsorption of CuPc and ZnPc on Noble Metal Surfaces by Combining Quantum-Mechanical Modelling and Photoelectron Spectroscopy

por Huang, Yu Li, Wruss, Elisabeth, Egger, David A., Kera, Satoshi, Ueno, Nobuo, Saidi, Wissam A., Bucko, Tomas, Wee, Andrew T.S., Zojer, Egbert
Publicado 2014

Outer-valence Electron Spectra of Prototypical Aromatic Heterocycles from an Optimally Tuned Range-Separated Hybrid Functional

por Egger, David A., Weissman, Shira, Refaely-Abramson, Sivan, Sharifzadeh, Sahar, Dauth, Matthias, Baer, Roi, Kümmel, Stephan, Neaton, Jeffrey B., Zojer, Egbert, Kronik, Leeor
Publicado 2014

A single atom change turns insulating saturated wires into molecular conductors

por Chen, Xiaoping, Kretz, Bernhard, Adoah, Francis, Nickle, Cameron, Chi, Xiao, Yu, Xiaojiang, del Barco, Enrique, Thompson, Damien, Egger, David A., Nijhuis, Christian A.
Publicado 2021