IWCN-2 Abstracts (2023)

• O. Adesina, M. Mahmoudi Gahrouei, A. Lee, R. Rurali, L. de Sousa Oliveira:
  "Evaluating Thermal Transport at The Axial Junction of Si-Ge Composite Nanowires";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 14 - 15.
  
  
• A. Alleysson, F. Michelini, M. Lannoo, S. Volz, M. Bescond:
  "Quantum transport of excitons in lateral TMDs heterostructures";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 102 - 103.
  
  
• L. Antonopoulos, D. Lewis, N. Funai, J. Davis, N. Menicucci:
  "A generalised framework for defining discrete Wigner functions via the Gottesman-Kitaev-Preskill code";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 80 - 81.
  
  
• K. Arnab, M. Scarpulla:
  "KROGER: An Extended Calculation Framework for Realistic Defect Modeling in Semiconductors";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 35 - 36.
  
  
• I. Baranowski, S.M. Goodnick, D. Vasileska:
  "Modeling of Non-Equilibrium Phonons in Hot Carrier Solar Cells";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 25 - 26.
  
  
• A. Barsotti, P. Marconcini, G. Procissi, M. Macucci:
  "Phase noise model for qubit control";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 144 - 145.
  
  
• A. Belanger, Z. Aksamija:
  "Phonon Monte Carlo Investigation of Hydrodynamic Transport in Graphene Micro Ribbons";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 75 - 76.
  
  
• A. Benali, J. Seoane, X. Cartoixa, X. Oriols:
  "Modeling strong light-matter interaction in polaritonic semiconductors as open systems";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 45 - 46.
  
  
• Y. J. Chan, M.-H. Chuang, C.-Y. Chen, Y. Li:
  "A Calibrated Mobility Model for Monolayer Molybdenum Disulfide Device Simulation";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 58 - 59.
  
  
• C.-Y. Chen, K.-L. Lee, S.-H. Hsu, M.-H. Chuang, Y. J. Chan, Y. Li:
  "Effect of Random Nanosized Titanium Nitride Grains on Monolayer MoS₂ Field-Effect Transistors";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 106 - 107.
  
  
• S. Chen, T. Li:
  "Impacts of Short-range Order on Thermal Conductivity of GeSn and Si-Ge-Sn Alloys";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 16.
  
  
• M.-H. Chuang, S. R. Kola, Y. Li:
  "Performance Boost of GAA Si NS CFET via Tungsten Source/Drain Sidewalls";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 113 - 114.
  
  
• A. Davies, I. Valdez, J. Hoberg, L. de Sousa Oliveira:
  "Honeycomb-Kagome Band Structures of Highly Tunable Graphene-Like Covalent Organic Frameworks";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 68 - 69.
  
  
• L. de Sousa Oliveira, A. Davies, N. Neophytos, P. Greaney, S. Hosseini, I. Dickey:
  "Super-suppression of Long Mean-free-path Phonons in Nanoporous Silicon";
  Talk: IWCN, Salt Lake City, UT (invited); 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 8 - 9.
  
  
• E. Deylgat, C.P. Chuu, E. Chen, B. Sorée, W. Vandenberghe:
  "Electrostatic Model of Metal-Induced Gap States in Metal Edge, Top and Hybrid Contacts to MoS₂ transistors";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 96 - 97.
  
  
• S. Dhruba, I. Knezevic:
  "Investigation of thermal transport and dislocations in lattice-matched InGaAs/InAlAs superlattices by nonequlibrium molecular dynamics simulations";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 10 - 11.
  
  
• M. Dossena, B. van Troeye, F. Ducry, J. Cao, A. Afzalian, G. Pourtois, M. Luisier:
  "Influence of disordered oxides on the mobility of monolayer WS₂: an ab initio study";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 104 - 105.
  
  
• M. Duhandzic, Z. Aksamija:
  "Charge carrier transport mechanism in doped conjugated polymers";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 41 - 42.
  
  
• M. Eryilmaz, I. Knezevic:
  "Thermal Conductivity of Nanowires: Machine Learning and Monte Carlo Insights";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 12 - 13.
  
  
• K. Esfarjani:
  "Predicting Thermal Conductivity and Classifying Chemical Bonds using DFT and Machine Learning";
  Talk: IWCN, Salt Lake City, UT (invited); 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 18.
  
  
• W.R. Frensley:
  "Design Principles for Discrete Models of Nanoelectronic Systems";
  Talk: IWCN, Salt Lake City, UT (invited); 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 133 - 134.
  
  
• S. Gangwal, T.-M. Lu, S. Chen, T. Li, M. Povolotskyi, D. Vasileska:
  "Hierarchical Framework for Modeling Electrostatics and Mobility in Ge_1-xSn_x/Ge Heterostructures";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 130 - 131.
  
  
• V. Ganiu, B. Arnaut, J. Neu, D. Schulz:
  "Impact of Slope Limiters on DG Methods Solving Quantum-Liouville Type Equations";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 82 - 83.
  
  
• L. Gnoli, E. Venuti, P. Graziosi:
  "A computational approach to polymorphism in BDT organic semiconductors";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 66 - 67.
  
  
• P. Graziosi, R. Della Valle, E. Venuti:
  "Electron-phonon coupling and mobility modeling in organic semiconductors: a new and efficient methodology";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 38 - 39.
  
  
• J. Gull, H. Kosina:
  "Electron-Electron Scattering in Monte Carlo-based Device Simulations";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 120 - 121.
  
  
• M. Haque, I. Knezevic:
  "Elastic-Wave Modeling of Long-Wavelength Phonon Dynamics in Superlattice Nanowires With Rough Interfaces";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 78 - 79.
  
  
• R. Helleboid, K. Morel-Handa, I. Nicholson, G. Mugny, D. Rideau:
  "Self-Consistent Advection-Diffusion Monte Carlo Simulation of Quenching in Single-Photon Avalanche Diodes";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 128 - 129.
  
  
• A. Jalali, N. Vlastos, M. Mahmoudi Gahrouei, L. de Sousa Oliveira:
  "Two-dimensional Magnetic Metal Organic Frameworks: Computational Study of Electron and Phonon Transport";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 70.
  
  
• A. Jensen, O. Adesina, J. Harter, L. de Sousa Oliveira:
  "Atomistic Modeling Insights of Thermal Boundary Transport Between a Surrogate Fuel (CeO₂) and a Fission Product (Pd)";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 77.
  
  
• M. Jeong, J. Kim, R.-G. Lee, H. Yeo, Y.-H. Kim:
  "First-principles study of the quasi-Fermi level splitting in ferrocene-based molecular junctions";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 43 - 44.
  
  
• G. N. Jonnalagadda, L. Hronek, Z. Futera:
  "Electron Transport in Biomolecular Junctions Studied by DFT and Tight Binding Approaches";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 40.
  
  
• G. N. Jonnalagadda, X. Wu, L. Hronek, Z. Futera:
  "Electron Transport Mechanisms in Cytochrome b₅₆₂ Junctions";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 71 - 72.
  
  
• G. Klimeck:
  "Attracting Students to Semiconductors through Interactive Learning Experiences - a Tutorial";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 5 - 6.
  
  
• A. Kolek:
  "Interband tunneling in a superlattice absorber";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 146 - 147.
  
  
• J. Lee, R.-G. Lee, H. Yeo, Y.-H. Kim:
  "Effects of the internal dipole alignment on the quantum transport properties of two-dimensional halide perovskite devices";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 141 - 142.
  
  
• D. Li, E. Polizzi:
  "A New Method for Bandstructure Calculation and Its Application to Edge Termination Effects in Graphene";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 92 - 93.
  
  
• D. Li, E. Polizzi:
  "Nonlinear Eigenvalue Algorithms with Applications";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 86 - 87.
  
  
• S. Li, P. Dollfus, J. Saint-Martin, D. Romanin:
  "Phonon Thermal Transport Along the Chain Direction of Crystalline Polyethylene";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 19 - 20.
  
  
• X. Li, S. Zhang, X. Zhang, Z. Vardeny, F. Liu:
  "Topological Nodal-Point Superconductivity in Two-Dimensional Ferroelectric Hybrid Perovskites";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 84 - 85.
  
  
• Y. Lim, M. Shin:
  "Robust Mode Space Method for Heterostructure Transport Enabled by Machine Learning Approach";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 56 - 57.
  
  
• B. Magyari-Koepe:
  "Innovating Tomorrow's Semiconductor Technology: Computational Strategies for Material Optimization";
  Talk: IWCN, Salt Lake City, UT (invited); 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 109 - 110.
  
  
• M. Mahmoudi Gahrouei, N. Vlastos, O. Adesina, R. D´Souza, E. Odogwu, L. de Sousa Oliveira:
  "Ab initio investigation of thermoelectric properties of two-dimensional MOFs";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 21 - 22.
  
  
• D. Mai, D. Schulz:
  "Applying POD-methods onto electron-phonon scattering in the Wigner equation";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 23 - 24.
  
  
• D. Mai, D. Schulz:
  "Importance of the Wigner equation for the analysis of the ballistic phonon transport";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 73 - 74.
  
  
• M. Makowiec, A. Kolek:
  "NEGF computation of optical absorption in InAs/GaSb type-II superlattices";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 47 - 48.
  
  
• S. Makumi, A. Belanger, Z. Aksamija:
  "Impact of Electrostatic Pressure on the TBC of 2D-Substrate Interfaces";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 100 - 101.
  
  
• D. Mamaluy, J. P. Mendez:
  "Phenomenological inelastic scattering model for electron transport in mesoscopic devices";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 31 - 32.
  
  
• S. Mansoori, E. Chen, M.V. Fischetti:
  "Theoretical Study of Carrier Transport in Bilayer Transition Metal Dichalcogenides";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 94 - 95.
  
  
• A. Martinez, J.R. Barker:
  "Scaled 1D NEGF model for 3D Oxide Barriers and Resonant Tunneling Diodes";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 139 - 140.
  
  
• D. Mejia, J. Verduzco, A. Strachan, G. Klimeck:
  "Changing the Typical Simulation Flow through Interactive Data Viewers and Drivers";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 50 - 51.
  
  
• J. P. Mendez, D. Mamaluy:
  "Predictive quantum transport simulations for advanced nano-scale FET-based sensors";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 148 - 149.
  
  
• S. Mitra, I. Knezevic:
  "Theoretical modeling of twist-angle-dependent plasmon resonances in moiré 2D materials";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 52 - 53.
  
  
• O. Muscato, V. Di Stefano:
  "Signed particle Monte Carlo quantum simulation of thermionic cooling devices based on resonant tunneling heterostructure";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 126 - 127.
  
  
• D. O. Nielsen, L. Nichols, S. Pantelides, X. Zhang, R. Schrimpf, M. Fleetwood, C. Van de Walle, M.V. Fischetti:
  "Thermalization and Effects of Radiation-Induced Charge-Carriers in Semiconductors and GaN/Al_0.25Ga_0.75N HEMTs";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 115 - 116.
  
  
• F. Passeri, A. Martinez, R. Grassi, K. Kalna:
  "Implementation of quantum transmitting boundary method in a 1D electron transport code";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 137 - 138.
  
  
• M. Pech, D. Schulz:
  "Time-resolved Quantum Transport in Open Systems: Phase Versus Real-Space Methods";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 135 - 136.
  
  
• E. Pop:
  "Electro-Thermal Transport in 2D Materials, Devices, and Applications";
  IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 89.
  
  
• B. Pruckner, W Goes, Siegfried Selberherr, V. Sverdlov:
  "Switching of Magnetization in Strained Noncollinear Antiferromagnet Mn₃Sn";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 33 - 34.
  
  
• T. Reiter, P. Manstetten, L. Filipovic:
  "GPU-based Monte Carlo Ray Tracing for Flux Calculation in Process Simulation";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 122 - 123.
  
  
• G. Romano:
  "Differentiable Phonon Hydrodynamic Simulations for Inverse Design and Material Property Extraction";
  Talk: IWCN, Salt Lake City, UT (invited); 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 28.
  
  
• A. C. Jr. Rossetto, C. S. Soares, D. Vasileska, G. I. Wirth:
  "Self-Heating and Hot Carrier Degradation Interaction in 28-nm FD-SOI pFETs";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 60 - 61.
  
  
• A. Sebbar, N. Cavassilas, Y. Guo, A. Saul, M. Nomura, S. Volz, M. Bescond:
  "Coherent thermal transport in isotopic graphene superlattices: a NEGF study";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 90 - 91.
  
  
• J. Seoane, A. Benali, X. Cartoixa, X. Oriols:
  "Exploring quantum technologies through THz polaritonic semiconductor devices";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 150 - 151.
  
  
• C. S. Soares, A. C. Jr. Rossetto, D. Vasileska, G. I. Wirth:
  "The impact of oxide-traps on n-NWFET using a quantum-corrected Monte Carlo simulator";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 124 - 125.
  
  
• C. S. Soares, M. Saraniti, S.M. Goodnick:
  "Design Considerations for a 5 nm n-FinFET using a Full-band Monte Carlo Simulator";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 54 - 55.
  
  
• W. Song, J. Yang:
  "Advancing Analog Precision: Memristor Technology for Scientific Computing";
  Talk: IWCN, Salt Lake City, UT (invited); 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 99.
  
  
• J. Sun, X. Liu, S. Li:
  "Unlocking high hole mobility in diamond over a wide temperature range via efficient shear strain";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 117 - 118.
  
  
• A. Tunga, M. Grupen, S. Rakheja:
  "A full 3D TCAD framework for nanosheet transistors including quantum-confined channels";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 111 - 112.
  
  
• N. Vlastos, N. Gindulis, L. de Sousa Oliveira:
  "Probing Light-Induced Isomerization Dynamics of Azobenzene Confined within Metal-Organic Frameworks: A Time-Dependent Density Functional Theory Investigation";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 64 - 65.
  
  
• A. Winka, L. Deuschle, J. Cao, A. Ziogas, A. Maeder, N. Vetsch, V. Maillou, M. Ciappa, M. Luisier:
  "Investigation of thermalization effects and hot carriers in ultra-scaled electronic devices";
  Talk: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 29 - 30.
  
  
• D. Zirbel, I. Knezevic:
  "Theoretical modeling of quantum-well structures in dilute bismide optoelectronics";
  Poster: IWCN, Salt Lake City, UT; 2025-05-21 - 2025-05-23; in: "Book of Abstracts IWCN5", (2025), 62 - 63.