Per Hyldgaard

Chalmers University of Technology — Sweden

Physics and Astronomy · Physical Sciences

39h-index7.9kcitations162works0.92yr avg
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Research Topics

Advanced Chemical Physics Studies(51), Graphene research and applications(36), Molecular Junctions and Nanostructures(29), Quantum and electron transport phenomena(25), Carbon Nanotubes in Composites(15)

Publications162 total

Nature of frontier quasi-particle states in nitrogen-base systems
Physical Chemistry Chemical Physics·2026Open Access
Wafer-Scale Single-Crystalline Monolayer Graphene
arXiv (Cornell University)·2025Open Access
Nature of frontier quasi-particle states in nitrogen-base systems
arXiv (Cornell University)·2025Open Access
Optimally tuned range-separated hybrid van der Waals density functional for molecular binding and quasiparticle characterizations
Journal of Physics Condensed Matter·2025Open Access
Polyvinyl fluoride: Predicting polarization in a complex soft matter system
Physical Review Materials·2024· 1 citedOpen Access
Range-separated hybrid van der Waals density functionals to describe Cu<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si21.svg" display="inline" id="d1e1037"><mml:msub><mml:mrow/><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:math>O<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si21.svg" display="inline" id="d1e1045"><mml:msub><mml:mrow/><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:math>-complexes
Chemical Physics Letters·2024· 3 citedOpen Access
Quantifying Atomic Volume, Partial Charge, and Electronegativity in Condensed Phases
The Journal of Physical Chemistry C·2024· 2 citedOpen Access
Quantifying Atomic Volume, Partial Charge and Electronegativity in Condensed Phases
2023· 2 citedOpen Access
A Density Functional Theory for the Average Electron Energy
Journal of Chemical Theory and Computation·2023· 11 citedOpen Access
Stability of and conduction in single-walled <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mrow><mml:mi>Si</mml:mi></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:mi>BN</mml:mi></mml:math> nanotubes
Physical Review Materials·2022· 2 citedOpen Access
Accurate Nonempirical Range-Separated Hybrid van der Waals Density Functional for Complex Molecular Problems, Solids, and Surfaces
Physical Review X·2022· 20 citedOpen Access
A Density Functional Theory for the Average Electron Energy
2022Open Access
An assessment of density functionals for predicting CO2 adsorption in diamine-functionalized metal–organic frameworks
The Journal of Chemical Physics·2022· 16 cited
Stability of and conduction in single-walled Si$_2$BN nanotubes
arXiv (Cornell University)·2022Open Access
Accurate non-empirical range-separated hybrid van der Waals density functional for complex molecular problems, solids, and surfaces
arXiv (Cornell University)·2022· 1 citedOpen Access
A Physical Expression of Electrons in Density Functional Theory
2022Open Access
Hard and soft materials: putting consistent van der Waals density functionals to work
Electronic Structure·2021· 10 citedOpen Access
vdW-DF-ahcx: a range-separated van der Waals density functional hybrid
Journal of Physics Condensed Matter·2021Open Access
Hard and soft materials: Putting consistent van der Waals density functionals to work
arXiv (Cornell University)·2021Open Access
Phonon Knudsen Flow in GaAs/AlAs Superlattices
2021· 6 cited
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Frequent Co-authors

Elsebeth Schröder(16), Kristian Berland(12), Bengt I. Lundqvist(10), David C. Langreth(7), Jesper Kleis(5), John W. Wilkins(5), Paul Erhart(5), Hanna A. Rydberg(4), N. Jacobson(4), Selman Hershfield(4), J. H. Davies(4), Timo Thonhauser(3), M. Dion(3), S. I. Simak(3), Mikael Kuisma(3), T. L. Einstein(3), Valentino R. Cooper(2), Aaron Puzder(2), Svetla D. Chakarova-Käck(2), André K. Kelkkanen(2)