Elsebeth Schröder

Biträdande professor at Department of Microtechnology and Nanoscience, Quantum Device Physics

Projects

2012–2017

The Swedish Graphene Initiative

Mikael Fogelström Department of Microtechnology and Nanoscience, Applied Quantum Physics
Floriana Lombardi Department of Microtechnology and Nanoscience, Quantum Device Physics
Avgust Yurgens Department of Microtechnology and Nanoscience, Quantum Device Physics
Herbert Zirath Department of Microtechnology and Nanoscience, Microwave Electronics
Jan Stake Department of Microtechnology and Nanoscience, Terahertz and Millimetre Wave Laboratory
Elsebeth Schröder Department of Microtechnology and Nanoscience, Quantum Device Physics
Jari Kinaret Department of Applied Physics, Condensed Matter Theory
Sergey Kubatkin Department of Microtechnology and Nanoscience, Quantum Device Physics
Tomas Löfwander Department of Microtechnology and Nanoscience, Applied Quantum Physics
Eva Olsson Department of Applied Physics, Eva Olsson Group
Andreas Isacsson Department of Applied Physics, Condensed Matter Theory
Niklas Rorsman Department of Microtechnology and Nanoscience, Microwave Electronics
Knut and Alice Wallenberg Foundation

2011–2013

Atomic-scale theory methods for sparse and soft matter

Elsebeth Schröder Department of Microtechnology and Nanoscience, Quantum Device Physics
Swedish Research Council (VR)

2015–2018

Pollutant physisorption and weak chemisorption - atomic-scale theory and calculations

Elsebeth Schröder Department of Microtechnology and Nanoscience, Quantum Device Physics
Swedish Research Council (VR)

There might be more projects where Elsebeth Schröder participates, but you have to be logged in as a Chalmers employee to see them.

Publications

2016

Involving High School Students in Computational Physics University Research: Theory Calculations of Toluene Adsorbed on Graphene

Jonas Ericsson, Teodor Husmark, Christoffer Mathiesen et al
PLoS ONE. Vol. 11 (8), p. e0159168
Scientific journal article - peer reviewed
2016

Graphene oxide and adsorption of chloroform: A density functional study

Elena Kuisma, Fredrik Hansson, Benjamin Lindberg et al
Journal of Chemical Physics. Vol. 144 (18), p. Art. no. 184704
Scientific journal article - peer reviewed
2016

A Mechanism for Highly Efficient Electrochemical Bubbling Delamination of CVD-Grown Graphene from Metal Substrates

Lihui Liu, X. Liu, Zhaoyao Zhan et al
Advanced Materials Interfaces. Vol. 3 (8)
Scientific journal article - peer reviewed
2015

Spin Signature of Nonlocal Correlation Binding in Metal-Organic Frameworks

T. Thonhauser, S. Zuluaga, C. A. Arter et al
Physical Review Letters. Vol. 115 (13)
Scientific journal article - peer reviewed
2015

van der Waals forces in density functional theory: a review of the vdW-DF method

Kristian Berland, Valentino R Cooper, Kyuho Lee et al
Reports on progress in physics. Vol. 78 (6), p. 066501
Scientific journal article - peer reviewed
2014

Interpretation of van der Waals density functionals

Per Hyldgaard, Kristian Berland, Elsebeth Schröder et al
Physical Review B. Vol. 90 (7), p. Art. no. 075148
Scientific journal article - peer reviewed
2014

van der Waals density functionals built upon the electron-gas tradition: Facing the challenge of competing interactions

Kristian Berland, Calvin A. Arter, Valentino R. Cooper et al
Journal of Chemical Physics. Vol. 140, p. 18A539
Scientific journal article - peer reviewed
2013

Methanol Adsorption on Graphene

Elsebeth Schröder,
Journal of Nanomaterials. Vol. 2013 (Art. no. 871706)
Scientific journal article - peer reviewed
2013

Harris-type van der Waals density functional scheme

Kristian Berland, Elisa Londero, Elsebeth Schröder et al
Physical Review B. Vol. 88 (4)
Scientific journal article - peer reviewed
2012

Benchmarking van der Waals density functionals with experimental data: potential-energy curves for H2 molecules on Cu(111), (100) and (110) surfaces

Kyuho Lee, Kristian Berland, Mina Yoon et al
Journal of Physics: Condensed Matter. Vol. 24 (42), p. artikel nr 424213
Scientific journal article - peer reviewed
2012

Desorption of n-alkanes from graphene: a van der Waals density functional study

Elisa Londero, Emma Karlson, Marcus Landahl et al
Journal of Physics: Condensed Matter. Vol. 24 (42), p. 424212
Scientific journal article - peer reviewed
2012

Physisorption of nucleobases on graphene: a comparative van der Waals study

Duy Le, Abdelkader Kara, Elsebeth Schröder et al
Journal of Physics: Condensed Matter. Vol. 24, p. 424210
Scientific journal article - peer reviewed
2012

A van der Waals density functional study of chloroform and other trihalomethanes on graphene

Joel Åkesson, Oskar Sundborg, Olof Wahlström et al
Journal of Chemical Physics. Vol. 137, p. 174702
Scientific journal article - peer reviewed
2011

Evaluation of a density functional with account of van der Waals forces using experimental data of H2 physisorption on Cu(111)

Kuyho Lee, André K. Kelkkanen, Kristian Berland et al
Physical Review B. Vol. 84, p. 193408
Scientific journal article - peer reviewed
2011

A van der Waals density functional study of adenine on graphene: Single-molecular adsorption and overlayer binding

Kristian Berland, Svetla D. Chakarova-Käck, VR Cooper et al
Journal of Physics: Condensed Matter. Vol. 23, p. 135001
Scientific journal article - peer reviewed
2011

Vanadium pentoxide (V2O5): a van der Waals density functional study

Elisa Londero, Elsebeth Schröder,
Computer Physics Communications. Vol. 182 (9), p. 1805-1809
Scientific journal article - peer reviewed
2010

Molecular systems, growth and overlayers: van der Waals density functional and first-principles thermodynamics calculations

Kristian Berland, Jochen Rohrer, A Kelkkanen et al
SNIC progress report 08/09. Swedish national infrastructure for computing.
Chapter in monograph, book
2010

Role of van der Waals bonding in the layered oxide V2O5: First-principles density-functional calculations

Elisa Londero, Elsebeth Schröder,
Physical Review B. Vol. 82 (5), p. 054116
Scientific journal article - peer reviewed
2010

Binding of polycyclic aromatic hydrocarbons and graphene dimers in density functional theory

Svetla D. Chakarova-Käck, Aleksandra Vojvodic, Jesper Kleis et al
New Journal of Physics. Vol. 12, p. Art. Nr. 013017
Scientific journal article - peer reviewed
2009

A density functional for sparse matter

D. C. Langreth, Bengt I. Lundqvist, Svetla D. Chakarova-Käck et al
Journal of Physics - Condensed Matter. Vol. 21 (8), p. 084203
Scientific journal article - peer reviewed
2008

Stacking Interactions and the Twist of DNA

V.R. Cooper, Timo Thonhauser, Aaron Puzder et al
Journal of the American Chemical Society. Vol. 130, p. 1304
Scientific journal article - peer reviewed
2008

Nature and strength of bonding in a crystal of semiconducting nanotubes: van der Waals density functional calculations and analytical results

Jesper Kleis, Elsebeth Schröder, Per Hyldgaard et al
Physical Review B. Condensed Matter and Materials Physics. Vol. 77 (20), p. 205422
Scientific journal article - peer reviewed
2007

Potassium intercalation in graphite: A van der Waals density-functional study

Eleni Ziambaras, Jesper Kleis, Elsebeth Schröder et al
Physical Review B . Vol. 76 (15), p. 155425
Scientific journal article - peer reviewed
2007

Adsorption of methylamine on alpha-Al203(0001) and alpha-Cr203(0001)

Øyvind Borck, Per Hyldgaard, Elsebeth Schröder et al
Physical Review B . Vol. 75 (3), p. 035403
Scientific journal article - peer reviewed
2007

Towards a working density-functional theory for polymers: First-principles determination of the polyethylene crystal structure

Jesper Kleis, Bengt I. Lundqvist, David C. Langreth et al
Physical Review B . Vol. 76 (10 ), p. 100201(R)
Scientific journal article - peer reviewed
2006

Adsorption of phenol on graphite(0001) and α-Al2O3(0001): Nature of van der Waals bonds from first-principles calculations

Svetla D. Chakarova-Käck, Øyvind Borck, Elsebeth Schröder et al
Physical Review B. Vol. 74, p. 155402
Scientific journal article - peer reviewed
2006

Adsorption of methanol and methoxy on the α-Cr2O3(0001) surface

Øyvind Borck, Elsebeth Schröder,
Journal of Physics: Condensed Matter. Vol. 18 (48), p. 10751
Scientific journal article - peer reviewed
2006

Adsorption of methylamine on α-Al203(0001) and α-Cr203(0001)

Øyvind Borck, Per Hyldgaard, Elsebeth Schröder et al
Preprint
2006

Comment on "Attracted by Long-Range Electron Correlation: Adenine on Graphite"

Svetla D. Chakarova-Käck, Elsebeth Schröder, Bengt I. Lundqvist et al
Report
2006

Potassium intercalation in graphite: A van der Waals density functional theory study

Eleni Ziambaras, Jesper Kleis, Elsebeth Schröder et al
Report
2006

Interactions in nanotube bundles: A first-principles investigation

Jesper Kleis, Per Hyldgaard, Elsebeth Schröder et al
Preprint
2006

First-principles determination of the polyethylene crystal structure

Jesper Kleis, Bengt I. Lundqvist, David C. Langreth et al
Preprint
2006

Adsorption of phenol on graphite(0001) and α-Al2O3(0001): Nature of van der Waals bonds from first-principles calculations

Svetla D. Chakarova-Käck, Øyvind Borck, Elsebeth Schröder et al
Preprint
2006

Application of van der Waals Density Functional to an Extended System: Adsorption of Benzene and Naphthalene on Graphite

Svetla D. Chakarova-Käck, Elsebeth Schröder, Bengt I. Lundqvist et al
Physical Review Letters. Vol. 96 (14), p. 146107
Scientific journal article - peer reviewed
2006

Dimers of polycyclic aromatic hydrocarbons in density functional theory

Svetla D. Chakarova-Käck, Jesper Kleis, Elsebeth Schröder et al
Preprint
2006

First-principles study of the adsorption of methanol at the alpha-Al2O3(0001) surface

Øyvind Borck, Elsebeth Schröder,
J. Phys.: Condens. Matter. Vol. 18, p. 1-12
Scientific journal article - peer reviewed
2005

Van der Waals density functional for general geometries (vol 92, art no 246401, 2004)

M. Dion, Henrik Rydberg, Elsebeth Schröder et al
PHYSICAL REVIEW LETTERS. Vol. 95, p. 109902
Scientific journal article - peer reviewed
2005

van der Waals interactions of the benzene dimer: Towards treatment of polycyclic aromatic hydrocarbon dimers

Svetla D. Chakarova-Käck, Elsebeth Schröder,
Materials Science and Engineering C. Vol. 25, p. 787
Scientific journal article - peer reviewed
2005

Van der Waals interaction of simple, parallel polymers

Jesper Kleis, Elsebeth Schröder,
Journal of Chemical Physics. Vol. 122, p. 164902
Scientific journal article - peer reviewed
2005

van der Waals interactions of polycyclic aromatic hydrocarbon dimers

Svetla D. Chakarova-Käck, Elsebeth Schröder,
Journal of Chemical Physics. Vol. 122 (5), p. 054102
Scientific journal article - peer reviewed
2005

Van der Waals Density Functional Theory with Applications

D. C. Langreth, Max Dion, Henrik Rydberg et al
International Journal of Quantum Chemistry. Vol. 101, p. 599
Scientific journal article - peer reviewed
2005

Van der Waals interaction of parallel polymers and nanotubes

Jesper Kleis, Per Hyldgaard, Elsebeth Schröder et al
Computational Materials Science. Vol. vol. 33, p. 192
Scientific journal article - peer reviewed
2004

Van der Waals Density Functional for General Geometries

Max Dion, Henrik Rydberg, Elsebeth Schröder et al
Phys. Rev. Lett.. Vol. 92, p. 246401
Scientific journal article - peer reviewed
2004

Mg(0001) Surface Oxidation: A Two-Dimensional Oxide Phase

Elsebeth Schröder, F. Fasel, A. Kiejna et al
Physical Review B. Vol. 69, p. 193405
Scientific journal article - peer reviewed
2004

O adsorption and incipient oxidation of the Mg(0001) surface

Elsebeth Schröder, R. Fasel, A. Kiejna et al
Physical Review B. Vol. 69, p. 115431
Scientific journal article - peer reviewed
2003

Van der Waals Interactions of Parallel and Concentric Nanotubes

Elsebeth Schröder, Per Hyldgaard,
Materials Science and Engineering C. Vol. 23, p. 721
Scientific journal article - peer reviewed
2003

Adsorption of Methanol on Aluminum Oxide: A Density Functional Study

Øyvind Borck, Elsebeth Schröder,
ATB-Metallurgie. Vol. 43, p. 342
Conference paper - peer reviewed
2003

Ultrathin Pd and Pt Films on W(211)

Jan Block, J.J. Kolodziej, J.E. Rowe et al
Thin Solid Films. Vol. 428, p. 47
Scientific journal article - peer reviewed
2003

The van der Waals Interactions of Concentric Nanotubes

Elsebeth Schröder, Per Hyldgaard,
Surface Science. Vol. 532, p. 880
Scientific journal article - peer reviewed
2003

Theory for structure and bulk modulus determination

Eleni Ziambaras, Elsebeth Schröder,
Physical Review B. Vol. 68, p. 064112
Scientific journal article - peer reviewed
2003

Van der Waals Density Functional for Layered Structures

Henrik Rydberg, Max Dion, Niclas Jacobson et al
Phys. Rev. Lett.. Vol. 91, p. 126402
Scientific journal article - peer reviewed
2002

The van der Waals Interactions of Concentric Nanotubes

Elsebeth Schröder, Per Hyldgaard,
Proceedings of NANO-7/ECOSS-21
Conference paper - non peer reviewed
2002

Oxidation of Mg(0001): A combined Experimental and Theoretical Study

Elsebeth Schröder, Roman Fasel, Adam Kiejna et al
Proceedings of NANO-7/ECOSS-21
Conference paper - non peer reviewed
2002

Bridging between micro- and macroscales of materials by mesoscopic models

Bengt I. Lundqvist, Alexander Bogicevic, Sergey V. Dudiy et al
Computational Materials Science. Vol. 24, p. 1
Scientific journal article - peer reviewed
2002

Hydrogen dynamics in magnesium and graphite

Niclas Jacobson, Bengt Tegner, Elsebeth Schröder et al
Computational Materials Science. Vol. 24, p. 273-277
Scientific journal article - peer reviewed
2002

Interaction effects in magnesium oxidation: A lattice-gas simulation

Elsebeth Schröder,
Computational Materials Science. Vol. 24, p. 105-110
Scientific journal article - peer reviewed
2001

Density-functional bridge between surfaces and interfaces

Bengt I. Lundqvist, Alexander Bogicevic, Karin M. Carling et al
Surface Science. Vol. 493, p. 253-270
Scientific journal article - peer reviewed
2000

Nematic liquid-crystal director configuration for general elastic coefficients

Elsebeth Schröder,
Physical Review E. Vol. 62 , p. 8830
Scientific journal article - peer reviewed
1999

Diffusion von Teilchen in turbulenten Oberflächenwellen

Elsebeth Schröder, Mogens T. Levinsen, Preben Alstrøm et al
C. Nowak, I. Wilke, U Wollmer (eds.) ``Kiss the Future! Physikerinnen stellen sich vor'', Tagungsband der Deutschen Physikerinnentagung 1998, Kirchlinteln: Hoho-Verlag Hoffmann und Hoyer , p. 171-175
Conference paper - non peer reviewed