QuantumATK: an integrated platform of electronic and atomic-scale modelling tools S Smidstrup, T Markussen, P Vancraeyveld, J Wellendorff, J Schneider, ... Journal of Physics: Condensed Matter 32 (1), 015901, 2019 | 1385 | 2019 |
Improved initial guess for minimum energy path calculations S Smidstrup, A Pedersen, K Stokbro, H Jónsson The Journal of chemical physics 140 (21), 2014 | 390 | 2014 |
First-principles Green's-function method for surface calculations: A pseudopotential localized basis set approach S Smidstrup, D Stradi, J Wellendorff, PA Khomyakov, UG Vej-Hansen, ... Physical Review B 96 (19), 195309, 2017 | 257 | 2017 |
Semiempirical model for nanoscale device simulations K Stokbro, DE Petersen, S Smidstrup, A Blom, M Ipsen, K Kaasbjerg Physical Review B—Condensed Matter and Materials Physics 82 (7), 075420, 2010 | 232 | 2010 |
ATK-ForceField: a new generation molecular dynamics software package J Schneider, J Hamaekers, ST Chill, S Smidstrup, J Bulin, R Thesen, ... Modelling and Simulation in Materials Science and Engineering 25 (8), 085007, 2017 | 112 | 2017 |
Method for determining optimal supercell representation of interfaces D Stradi, L Jelver, S Smidstrup, K Stokbro Journal of Physics: Condensed Matter 29 (18), 185901, 2017 | 106 | 2017 |
Proximity band structure and spin textures on both sides of topological-insulator/ferromagnetic-metal interface and their charge transport probes JM Marmolejo-Tejada, K Dolui, P Lazic, PH Chang, S Smidstrup, D Stradi, ... Nano letters 17 (9), 5626-5633, 2017 | 81 | 2017 |
Nonequilibrium spin texture within a thin layer below the surface of current-carrying topological insulator : A first-principles quantum transport study PH Chang, T Markussen, S Smidstrup, K Stokbro, BK Nikolić Physical Review B 92 (20), 201406, 2015 | 56 | 2015 |
Complex band structure and electronic transmission eigenchannels A Jensen, M Strange, S Smidstrup, K Stokbro, GC Solomon, MG Reuter The Journal of Chemical Physics 147 (22), 2017 | 13 | 2017 |
Electron transport across a metal-organic interface: simulations using nonequilibrium Green's function and density functional theory K Stokbro, S Smidstrup Physical Review B—Condensed Matter and Materials Physics 88 (7), 075317, 2013 | 12 | 2013 |
Hierarchical modeling for TCAD simulation of short-channel 2D material-based FETs L Silvestri, M Palsgaard, R Rhyner, M Frey, J Wellendorff, S Smidstrup, ... Solid-State Electronics 200, 108533, 2023 | 7 | 2023 |
Heterogeneous integration enabled by the state-of-the-art 3DIC and CMOS technologies: Design, cost, and modeling XW Lin, V Moroz, X Xu, Y Gao, D Rennie, P Asenov, S Smidstrup, ... 2021 IEEE International Electron Devices Meeting (IEDM), 3.4. 1-3.4. 4, 2021 | 7 | 2021 |
Challenges in design and modeling of cold CMOS HPC technology V Moroz, J Kawa, XW Lin, AR Brown, P Asenov, J Lee, M Bajaj, ... 2021 International Conference on Simulation of Semiconductor Processes and …, 2021 | 6 | 2021 |
Ab initio LCAO hybrid density-functional method for accurate, large-scale electronic structure simulations of semiconductor materials, interfaces and gate stacks PA Khomyakov, J Wellendorff, M Palsgaard, T Gunst, H Miyagi, ... 2021 International Conference on Simulation of Semiconductor Processes and …, 2021 | 3 | 2021 |
Atomistic simulation of a III-V pin junction: Comparison of density functional and tight-binding approaches K Stokbro, A Blom, S Smidstrup 2013 International Conference on Simulation of Semiconductor Processes and …, 2013 | 3 | 2013 |
Shockley-Read-Hall recombination and trap levels in point defects from first principles CD Vedel, T Gunst, S Smidstrup, VP Georgiev Physical Review B 108 (9), 094113, 2023 | 2 | 2023 |
A multiscale statistical evaluation of DRAM variable retention time P Asenov, SM Amoroso, J Lee, F Corsetti, P Vancraeyveld, SØ Smidstrup, ... 2021 5th IEEE Electron Devices Technology & Manufacturing Conference (EDTM), 1-3, 2021 | 2 | 2021 |
First-principles investigation of polytypic defects in InP CD Vedel, S Smidstrup, VP Georgiev Scientific Reports 12 (1), 19724, 2022 | 1 | 2022 |
Atomistic modeling of nanoscale ferroelectric capacitors using a density functional theory and non-equilibrium Green’s-function method D Stradi, UG Vej-Hansen, PA Khomyakov, ME Lee, G Penazzi, A Blom, ... 2019 International Conference on Simulation of Semiconductor Processes and …, 2019 | 1 | 2019 |
Topological-insulator/ferromagnetic-metal interface band and spin structure decoded by first-principles Green functions and tunneling anisotropic magnetoresistance JM Marmolejo-Tejada, PH Chang, P Lazic, S Smidstrup, D Stradi, ... ArXiv e-prints, 2017 | 1 | 2017 |