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The Journal of Physical Chemistry. A|May 29, 2007
The Green's function density functional tight-binding (gDFTB) method for molecular electronic conductionJeffrey R Reimers, Gemma C Solomon, Alessio Gagliardi, et al.
Journal of Chemical Theory and Computation|May 8, 2025
Hybrid Functional DFTB Parametrizations for Modeling Organic Photovoltaic SystemsWenbo Sun, Tammo van der Heide, Van-Quan Vuong, et al.
The Journal of Chemical Physics|October 22, 2005
Structures and energetics of hydrogen-terminated silicon nanowire surfacesR Q Zhang, Y Lifshitz, D D D Ma, et al.
Nanoscale|August 23, 2017
Plasmon-driven sub-picosecond breathing of metal nanoparticlesFranco P Bonafé, Bálint Aradi, Mengxue Guan, et al.
Advanced Science (Weinheim, Baden-Wurttemberg, Germany)|December 14, 2025
Phase-Engineered Non-Degenerate Sliding Ferroelectricity Enables Tunable Photovoltaics in Monolayer Janus In<sub>2</sub>S<sub>2</sub>SeYixuan Li, Qiang Wang, Keying Han, et al.
Angewandte Chemie (International Ed. in English)|April 13, 2023
Insight into the Molecular Mechanism for Enhanced Longevity of Supramolecular Vesicular PhotocatalystsYannan Liu, Fulu Zheng, Haojie Dai, et al.
Nano Letters|June 28, 2014
Intense intrashell luminescence of Eu-doped single ZnO nanowires at room temperature by implantation created Eu-Oi complexesSebastian Geburt, Michael Lorke, Andreia L da Rosa, et al.
The Journal of Physical Chemistry Letters|January 13, 2025
Ultrafast Laser-Induced Spin Dynamics in All-Semiconductor Ferromagnetic CrSBr-Phosphorene HeterostructuresYiqi Huo, Shuo Li, Luo Yan, et al.
The Journal of Physical Chemistry Letters|December 11, 2023
Controlling Charge Carrier Dynamics in Porphyrin Nanorings by Optically Active TemplatesShrabanti Mondal, Uttam Chowdhury, Subhajit Dey, et al.
Nanoscale|August 30, 2014
Oxygen vacancy diffusion in bare ZnO nanowiresBei Deng, Andreia Luisa da Rosa, Th Frauenheim, et al.
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