Egbert Zojer

Ao.Univ.-Prof. Dipl.-Ing. Dr.techn.

19962021
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Research Output 1996 2019

2019

Analyzing the Electronic Coupling in Molecular Crystals—The Instructive Case of α‐Quinacridone

Winkler, C., Mayer, F. & Zojer, E., 28 May 2019, In : Advanced Theory and Simulations. 2, 5, 1800204.

Research output: Contribution to journalArticleResearchpeer-review

Open Access
2018

Controlling the electronic properties of van der Waals heterostructures by applying electrostatic design

Winkler, C., Harivyasi, S. S. & Zojer, E., 11 May 2018, In : 2D Materials. 5, 3, p. 035019 1 p.

Research output: Contribution to journalArticleResearchpeer-review

Open Access
Electronic properties
Transition metals
Heterojunctions
Electrostatics
electrostatics

Distinguishing between Charge-Transfer Mechanisms at Organic/Inorganic Interfaces Employing Hybrid Functionals

Wruss, E., Zojer, E. & Hofmann, O. T., 5 Jul 2018, In : Journal of Physical Chemistry C. 122, 26, p. 14640-14653 14 p.

Research output: Contribution to journalArticleResearchpeer-review

functionals
Charge transfer
charge transfer
Density functional theory
Substrates

Embedded Dipole Self-Assembled Monolayers for Contact Resistance Tuning in p-Type and n-Type Organic Thin Film Transistors and Flexible Electronic Circuits

Petritz, A., Krammer, M., Sauter, E., Gärtner, M., Nascimbeni, G., Schrode, B., Fian, A., Cojocaru, A., Gold, H., Karner-Petritz, E., Resel, R., Terfort, A., Zojer, E., Zharnikov, M., Zojer, K. & Stadlober, B., 26 Sep 2018, In : Advanced functional materials. 28, 45, p. 1804462 12 p.

Research output: Contribution to journalArticleResearchpeer-review

Open Access

Evaluating different Models for the Analysis of Tunneling Current-Voltage Curves in Metal-Molecule-Metal Molecular Junctions

Taucher, T. C., Obersteiner, V. & Zojer, E., 11 Jul 2018.

Research output: Contribution to conferencePosterResearchpeer-review

Structural, Spectroscopic, and Computational Characterization of the Concomitant Polymorphs of the Natural Semiconductor Indigo

Salzillo, T., D'Agostino, S., Rivalta, A., Giunchi, A., Brillante, A., Della Valle, R. G., Bedoya-Martínez, N., Zojer, E., Grepioni, F. & Venuti, E., 16 Aug 2018, In : Journal of Physical Chemistry C. 122, 32, p. 18422-18431 10 p.

Research output: Contribution to journalArticleResearchpeer-review

Indigo Carmine
Polymorphism
Semiconductor materials
Raman spectroscopy
casts

Toward a Reliable Description of the Lattice Vibrations in Organic Molecular Crystals: The Impact of van der Waals Interactions

Bedoya-Martínez, N., Giunchi, A., Salzillo, T., Venuti, E., Della Valle, R. G. & Zojer, E., 14 Aug 2018, In : Journal of chemical theory and computation. 14, 8, p. 4380-4390 11 p.

Research output: Contribution to journalArticleResearchpeer-review

Molecular crystals
Lattice vibrations
lattice vibrations
Density functional theory
density functional theory

Transition Voltage: Coverage Dependance and Impact of Anchoring Groups

Taucher, T. C., Obersteiner, V. & Zojer, E., 11 Sep 2018.

Research output: Contribution to conferencePosterResearchpeer-review

electric potential
electronic structure
electronics
energy levels
photoelectron spectroscopy

Tunneling Probability Increases with Distance in Junctions Comprising Self-Assembled Monolayers of Oligothiophenes

Zhang, Y., Soni, S., Krijger, T. L., Gordiichuk, P., Qiu, X., Ye, G., Jonkman, H. T., Herrmann, A., Zojer, K., Zojer, E. & Chiechi, R. C., 7 Nov 2018, In : Journal of the American Chemical Society. 140, 44, p. 15048-15055 8 p.

Research output: Contribution to journalArticleResearchpeer-review

Self assembled monolayers
Charge transfer
Electrodes
Molecular electronics
Molecules

Understanding the Properties of Tailor-Made Self-Assembled Monolayers with Embedded Dipole Moments for Interface Engineering

Gärtner, M., Sauter, E., Nascimbeni, G., Petritz, A., Wiesner, A., Kind, M., Abu-Husein, T., Bolte, M., Stadlober, B., Zojer, E., Terfort, A. & Zharnikov, M., 20 Dec 2018, In : Journal of Physical Chemistry C. 122, 50, p. 28757-28774 18 p.

Research output: Contribution to journalArticleResearchpeer-review

Dipole moment
Self assembled monolayers
dipole moments
engineering
electronics

Van der Waals Interaction Activated Strong Electronic Coupling at the Interface between Chloro Boron-Subphthalocyanine and Cu(111)

Harivyasi, S. S., Hofmann, O. T., Ilyas, N., Monti, O. L. A. & Zojer, E., 2018, In : Journal of Physical Chemistry C. 122, 6, p. 14621-14630

Research output: Contribution to journalArticleResearchpeer-review

Boron
Van der Waals forces
boron
Molecules
electronics
2017

Controlling Charge Transport through Molecular Monolayers by Electrostatic Design

Taucher, T. C., Obersteiner, V. & Zojer, E., 25 Sep 2017.

Research output: Contribution to conferencePosterResearchpeer-review

DFT-Assisted Polymorph Identification from Lattice Raman Fingerprinting

Bedoya-Martínez, N., Schrode, B., Jones, A. O. F., Salzillo, T., Ruzié, C., Demitri, N., Geerts, Y. H., Venuti, E., Della Valle, R. G., Zojer, E. & Resel, R., 3 Aug 2017, In : Journal of Physical Chemistry Letters. 8, 15, p. 3690-3695 6 p.

Research output: Contribution to journalArticleResearchpeer-review

Lattice vibrations
Polymorphism
Density functional theory
density functional theory
lattice vibrations

Effects of Embedded Dipole Layers on Electrostatic Properties of Alkanethiolate Self-Assembled Monolayers

Cabarcos, O. M., Schuster, S., Hehn, I., Zhang, P. P., Maitani, M. M., Sullivan, N., Giguère, J. B., Morin, J. F., Weiss, P. S., Zojer, E., Zharnikov, M. & Allara, D. L., 27 Jul 2017, In : Journal of Physical Chemistry C. 121, 29, p. 15815-15830 16 p.

Research output: Contribution to journalArticleResearchpeer-review

Self assembled monolayers
esters
Electrostatics
electrostatics
dipoles

Electrostatic Control of Ballistic Transport through Self-Assembled Monolayers

Taucher, T. C., Obersteiner, V. & Zojer, E., 22 Jun 2017.

Research output: Contribution to conferencePosterResearchpeer-review

Electrostatic Design of 3D Covalent Organic Networks

Obersteiner, V., Jeindl, A., Götz, J., Perveaux, A., Hofmann, O. T. & Zojer, E., 19 Jul 2017, In : Advanced Materials. 29, 27, 1700888.

Research output: Contribution to journalArticleResearchpeer-review

Electrostatics
Charge carriers
Excitons
Functional groups
Electronic structure

Exploring the driving forces behind the structural assembly of biphenylthiolates on Au(111)

Verwüster, E., Wruss, E., Zojer, E. & Hofmann, O. T., 14 Jul 2017, In : Journal of Chemical Physics. 147, 2, 024706.

Research output: Contribution to journalArticleResearchpeer-review

Self assembled monolayers
assembly
Adsorbates
Potential energy surfaces
Molecules

Fully Atomistic Understanding of the Electronic and Optical Properties of a Prototypical Doped Charge-Transfer Interface

Baby, A., Gruenewald, M., Zwick, C., Otto, F., Forker, R., Van Straaten, G., Franke, M., Stadtmüller, B., Kumpf, C., Brivio, G. P., Fratesi, G., Fritz, T. & Zojer, E., 24 Oct 2017, In : ACS Nano. 11, 10, p. 10495-10508 14 p.

Research output: Contribution to journalArticleResearchpeer-review

Electronic properties
Charge transfer
Optical properties
charge transfer
Doping (additives)

Intentional Modification of Electronic Structure in MoS2 Monolayer

Harivyasi, S. S. & Zojer, E., 21 Jun 2017.

Research output: Contribution to conferencePosterResearch

Orientation-dependent work-function modification using substituted pyrene-based acceptors

Hofmann, O. T., Glowatzki, H., Bürker, C., Rangger, G. M., Bröker, B., Niederhausen, J., Hosokai, T., Salzmann, I., Blum, R. P., Rieger, R., Vollmer, A., Rajput, P., Gerlach, A., Müllen, K., Schreiber, F., Zojer, E., Koch, N. & Duhm, S., 2017, In : Journal of Physical Chemistry C. 121, 39

Research output: Contribution to journalArticleResearchpeer-review

Pyrene
pyrenes
Crystal orientation
Electron affinity
electron affinity

Relative Thermal Stability of Thiolate- and Selenolate-Bonded Aromatic Monolayers on the Au(111) Substrate

Ossowski, J., Nascimbeni, G., Zaba, T., Verwüster, E., Rysz, J., Terfort, A., Zharnikov, M., Zojer, E. & Cyganik, P., 21 Dec 2017, In : Journal of Physical Chemistry C. 121, 50, p. 28031-28042 12 p.

Research output: Contribution to journalArticleResearchpeer-review

Self assembled monolayers
Monolayers
Thermodynamic stability
thermal stability
Substrates

Unconventional Current Scaling and Edge Effects for Charge Transport through Molecular Clusters

Obersteiner, V., Huhs, G., Papior, N. & Zojer, E., 13 Dec 2017, In : Nano Letters. 17, 12, p. 7350-7357 8 p.

Research output: Contribution to journalArticleResearchpeer-review

molecular clusters
Charge transfer
scaling
Molecules
molecules
2016

Complex Stoichiometry-Dependent Reordering of 3,4,9,10-Perylenetetracarboxylic Dianhydride on Ag(111) upon K Intercalation

Zwick, C., Baby, A., Gruenewald, M., Verwüster, E., Hofmann, O., Forker, R., Fratesi, G., Brivio, G. P., Zojer, E. & Fritz, T., 2016, In : ACS Nano. 10, p. 2365

Research output: Contribution to journalArticleResearchpeer-review

Dipole-induced asymmetric conduction in tunneling junctions comprising self-assembled monolayers

Kovalchuk, A., Egger, D., Abu-Hussein, T., Zojer, E., Terfort, A. & Chiechi, R., 2016, In : RSC Advances . 6, p. 69479

Research output: Contribution to journalArticleResearchpeer-review

Electronic properties of 1,2;8,9-dibenzopentacene in solutions, solid matrices and thin films

Tovstopyat, A., Zojer, E. & Leising, G., 2016, In : Journal of applied spectroscopy. 83, 1, p. 20-26

Research output: Contribution to journalArticleResearchpeer-review

Employing X-ray Photoelectron Spectroscopy for Determining Layer Homogeneity in Mixed Polar Self-Assembled Monolayers

Hehn, I., Schuster, S., Wächter, T., Abu-Hussein, T., Zharnikov, M. & Zojer, E., 2016, In : The journal of physical chemistry letters . 7, p. 2994

Research output: Contribution to journalArticleResearchpeer-review

On the adsorption behavior of nonplanar phthalocyanines: Competition of different adsorption conformations

Wruß, E., Hofmann, O., Egger, D., Verwüster, E., Gerlach, A., Schreiber, F. & Zojer, E., 2016, In : The journal of physical chemistry (Washington, DC) / C. 120, p. 6869

Research output: Contribution to journalArticleResearchpeer-review

Sticking with the Pointy End? Molecular Configuration of Chloro Boron-Subphthalocyanine on Cu(111)

Ilyas, N., Harivyasi, S. S., Zahl, P., Cortes, R., Hofmann, O. T., Sutter, P., Zojer, E. & Monti, O. L. A., 7 Apr 2016, In : Journal of Physical Chemistry C. 120, 13, p. 7113-7121 9 p.

Research output: Contribution to journalArticleResearchpeer-review

Boron
boron
Scanning tunneling microscopy
Molecules
Adsorption

Transition Voltages Respond to Synthetic Reorientation of Embedded Dipoles in Self-Assembled Monolayers

Kovalchuk, A., Abu-Husein, T., Fracasso, D., Egger, D., Zojer, E., Zharnikov, M., Terfort, A. & Chiechi, R., 2016, In : Chemical science. 7, p. 781-787

Research output: Contribution to journalArticleResearchpeer-review

Understanding Chemical vs. Electrostatic Shifts in X-ray Photoelectron Spectra of Organic Self-Assembled Monolayers

Taucher, T., Hehn, I., Hofmann, O., Zharnikov, M. & Zojer, E., 2016, In : The journal of physical chemistry (Washington, DC) / C. p. 3428-3437

Research output: Contribution to journalArticleResearchpeer-review

2015

Adsorption behavior of nonplanar GaCl-phthalocyanine on Cu(111): Geometric and electronic properties

Wruß, E., Egger, D., Hofmann, O., Gerlach, A., Schreiber, F. & Zojer, E., 2015.

Research output: Contribution to conferencePosterResearch

A new perspective on the adsorption behavior of nonplanar GaClphthalocyanine on Cu(111)

Wruß, E., Egger, D., Hofmann, O., Gerlach, A., Schreiber, F. & Zojer, E., 2015.

Research output: Contribution to conferencePosterResearch

Architecture-specific Contributions to Short Channel Effects in Organic Transistors

Fernandez Fernandez, A., Zojer, E. & Zojer, K., 2015.

Research output: Contribution to conferencePosterResearch

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

Kretz, B., Egger, D. & Zojer, E., 2015, In : Advanced Science . 2, 3, p. 1400016-ff

Research output: Contribution to journalArticleResearchpeer-review

Charge Transport through Molecular Monolayers: Impact of Collective Effects and Docking Groups

Obersteiner, V., Egger, D., Heimel, G. & Zojer, E., 15 Mar 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Disorder at organic/inorganic interfaces

Obersteiner, V., Zojer, E. & Hofmann, O., 2015.

Research output: Contribution to conferencePosterResearch

Effects of embedded dipole in alkanethiolate self-assembled monolayers

Schuster, S., Sullivan, N., Cabracos, O., Hehn, I., Morin, J-F., Zojer, E., Allara, D. & Zharnikov, M., 15 Mar 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Electronic Properties of Biphenylthiolates on Au(111): The impact of coverage revisited

Verwüster, E., Hofmann, O., Egger, D. & Zojer, E., 2015, In : The journal of physical chemistry (Washington, DC) / C. 119, p. 7817-ff

Research output: Contribution to journalArticleResearchpeer-review

Electrostatically designing the electronic properties of organic semiconductors and interfaces

Egger, D., Obersteiner, V., Kraberger, G., Kretz, B., Jeindl, A., Götz, J., Abu-Husein, T., Schuster, S., Terfort, A., Zharnikov, M. & Zojer, E., 13 Oct 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Electrostatic design of interfaces with organic semiconductors

Obersteiner, V., Kraberger, G., Kretz, B., Jeindl, A., Götz, J., Egger, D. & Zojer, E., 28 Jun 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Electrostatic design of monolayer properties

Kretz, B., Egger, D. & Zojer, E., 2015.

Research output: Contribution to conferencePosterResearch

Electrostatic design of monolayer properties

Kretz, B., Egger, D. & Zojer, E., 15 Mar 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Electrostatic design of organic semiconductors and interfaces

Zojer, E., Egger, D., Obersteiner, V., Kraberger, G., Kretz, B., Jeindl, A., Götz, J., Abu-Husein, T., Schuster, S., Terfort, A. & Zharnikov, M., 27 Sep 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Exploiting unique properties of layered inorganic semiconductors

Harivyasi, S. S., Hofmann, O. & Zojer, E., 2015.

Research output: Contribution to conferencePosterResearch

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

Obersteiner, V., Egger, D. & Zojer, E., 2015, In : The journal of physical chemistry (Washington, DC) / C. 119, p. 21198-21208

Research output: Contribution to journalArticleResearchpeer-review

Impact of the capacitance of the dielectric on the contact resistance in organic transistors

Zojer, K., Zojer, E., Fernandez Fernandez, A. & Gruber, M., 2015, In : Physical review applied. 4, p. 044002-ff

Research output: Contribution to journalArticleResearchpeer-review

Investigating organic monolayer/layered inorganic semiconductor hybrid systems

Harivyasi, S. S., Hofmann, O. & Zojer, E., 2015.

Research output: Contribution to conferencePosterResearch

Modeling geometry and electronic structure of flat-lying phthalocyanines on metal surfaces

Wruß, E., Egger, D., Huang, Y., Bucko, T., Saidi, W. A., Kera, S. & Zojer, E., 15 Mar 2015.

Research output: Contribution to conference(Old data) Lecture or PresentationResearch

Modeling of “Realistic” Self-Assembled Monolayers on Au(111)

Verwüster, E., Egger, D., Hofmann, O. & Zojer, E., 2015.

Research output: Contribution to conferencePosterResearch