QuantumATK: an integrated platform of electronic and atomic-scale modelling tools
Smidstrup, Søren, Markussen, Troels, Vancraeyveld, Pieter, Wellendorff, Jess, Schneider, Julian, Gunst, Tue, Verstichel, Brecht, Stradi, Daniele, Khomyakov, Petr A, Vej-Hansen, Ulrik G, Lee, Maeng-Eun, Chill, Samuel T, Rasmussen, Filip, Penazzi, Gabriele, Corsetti, Fabiano, Ojanperä, Ari, Jensen, Kristian, Palsgaard, Mattias L N, Martinez, Umberto, Blom, Anders, Brandbyge, Mads, Stokbro, Kurt
Published in Journal of physics. Condensed matter (01.01.2020)
Published in Journal of physics. Condensed matter (01.01.2020)
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Journal Article
Semiconductor band alignment from first principles: A new nonequilibrium Green's function method applied to the CZTSe/CdS interface for photovoltaics
Palsgaard, Mattias L. N., Crovetto, Andrea, Gunst, Tue, Markussen, Troels, Hansen, Ole, Stokbro, Kurt, Brandbyge, Mads
Published in 2016 International Conference on Simulation of Semiconductor Processes and Devices (SISPAD) (01.09.2016)
Published in 2016 International Conference on Simulation of Semiconductor Processes and Devices (SISPAD) (01.09.2016)
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Conference Proceeding
Stacked Janus Device Concepts: Abrupt pn-Junctions and Cross-Plane Channels
Palsgaard, Mattias, Gunst, Tue, Markussen, Troels, Thygesen, Kristian Sommer, Brandbyge, Mads
Published in Nano letters (14.11.2018)
Published in Nano letters (14.11.2018)
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Journal Article
First-Principles Electron Transport with Phonon Coupling: Large-Scale at Low Cost
Gunst, Tue, Markussen, Troels, Palsgaard, Mattias L N, Stokbro, Kurt, Brandbyge, Mads
Published in arXiv.org (18.10.2017)
Published in arXiv.org (18.10.2017)
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Journal Article
Hierarchical modeling for TCAD simulation of short-channel 2D material-based FETs
Silvestri, Luca, Palsgaard, Mattias, Rhyner, Reto, Frey, Martin, Wellendorff, Jess, Smidstrup, Søren, Gull, Ronald, Sayed, Karim El
Published in Solid-state electronics (01.02.2023)
Published in Solid-state electronics (01.02.2023)
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Journal Article
QuantumATK: An integrated platform of electronic and atomic-scale modelling tools
Smidstrup, Søren, Markussen, Troels, Vancraeyveld, Pieter, Wellendorff, Jess, Schneider, Julian, Gunst, Tue, Verstichel, Brecht, Stradi, Daniele, Khomyakov, Petr A, Vej-Hansen, Ulrik G, Lee, Maeng-Eun, Chill, Samuel T, Rasmussen, Filip, Penazzi, Gabriele, Corsetti, Fabiano, Ojanperä, Ari, Jensen, Kristian, Palsgaard, Mattias L N, Martinez, Umberto, Blom, Anders, Brandbyge, Mads, Stokbro, Kurt
Published in arXiv.org (21.08.2019)
Published in arXiv.org (21.08.2019)
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Journal Article
Unravelling the role of inelastic tunneling into pristine and defected graphene
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Paper
Journal Article
New approaches for first-principles modelling of inelastic transport in nanoscale semiconductor devices with thousands of atoms
Gunst, Tue, Brandbyge, Mads, Palsgaard, Mattias, Markussen, Troels, Stokbro, Kurt
Published in 2017 International Conference on Simulation of Semiconductor Processes and Devices (SISPAD) (01.09.2017)
Published in 2017 International Conference on Simulation of Semiconductor Processes and Devices (SISPAD) (01.09.2017)
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Conference Proceeding
Ab initio LCAO hybrid density-functional method for accurate, large-scale electronic structure simulations of semiconductor materials, interfaces and gate stacks
Khomyakov, Petr A., Wellendorff, Jess, Palsgaard, Mattias, Gunst, Tue, Miyagi, Haruhide, Verstichel, Brecht, Corsetti, Fabiano, Arcisauskaite, Vaida, Martinez, Umberto, Blom, Anders, Smidstrup, Soren
Published in 2021 International Conference on Simulation of Semiconductor Processes and Devices (SISPAD) (27.09.2021)
Published in 2021 International Conference on Simulation of Semiconductor Processes and Devices (SISPAD) (27.09.2021)
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Conference Proceeding
Efficient first-principles calculation of phonon assisted photocurrent in large-scale solar cell devices
Palsgaard, Mattias, Markussen, Troels, Gunst, Tue, Brandbyge, Mads, Stokbro, Kurt
Published in arXiv.org (11.01.2018)
Published in arXiv.org (11.01.2018)
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Paper
Journal Article
Interface band gap narrowing behind open circuit voltage losses in Cu$_2$ZnSnS$_4$ solar cells
Crovetto, Andrea, Palsgaard, Mattias, Gunst, Tue, Markussen, Troels, Stokbro, Kurt, Brandbyge, Mads, Hansen, Ole
Year of Publication 14.02.2017
Year of Publication 14.02.2017
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Journal Article
Electron-phonon scattering from Green's function transport combined with Molecular Dynamics: Applications to mobility predictions
Markussen, Troels, Palsgaard, Mattias, Stradi, Daniele, Gunst, Tue, Brandbyge, Mads, Stokbro, Kurt
Published in arXiv.org (11.01.2017)
Published in arXiv.org (11.01.2017)
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Journal Article