| title | author | year |
|---|---|---|
| Formation and Electronic Structures of Perovslite Semiconductor Nanodots; First-principles Calculations | Ami TOMITA | 2023 |
| First-principles Calculations of Ferroelectricity of HfO2 | Kazuyoshi MAKI | 2023 |
| Oxygen-Vacancy Charging Induced Structural Change of Metal Oxides: First-principles Study | Kazuaki ARAI | 2022 |
| Theoretical Study on Tunneling Current Fluctuation through Semiconductor pn Junctions with Defects and Impurities | Jyurai KATO | 2022 |
| Fermi-level Depinning at Simple Metal/Ge Interfaces: First-principles Study | Akira NISHIMOTO | 2022 |
| First-principles study on Schottky barrier modulation at metal/Ge interfaces | Kayo UEDA | 2021 |
| First-principles study of diffusion and distribution of oxygen vacancies in metal oxides | Takuya OIKAWA | 2021 |
| First-principles study of two photon absorption spectra in perovskite semiconductors | Jyunna HATSUSHIKA | 2021 |
| Charging-induced formation of ferroelectric orthorhombic HfO2: first-principles study | Yuto SHIRAISHI | 2020 |
| Theory of tunneling currents at Si-p/n junctions with potential modulations | Sanghun CHO | 2020 |
| First-principles calculation of doping properties in Pb-perovskite halide semiconductors | Satoshi AKAI | 2019 |
| Defect formation at metal/semiconductor interfaces in electric field: first-principles study | Riki NAGASAWA | 2019 |
| Origin of Fermi-level depinning at metal/Ge interfaces: first-principles atudy | Toshiki NISHIMOTO | 2019 |
| First-principles calculation of metal-atom penetration into organic molecular solids | Shunta WATANABE | 2019 |
| First-principles study on stability of metal clusters in SiO2 insulators | Syota YAMAZAKI | 2018 |
| Ionization and penetration of metal atoms at metal/insulator interfaces in electric field and effects of metal alloying | Yoshihiro ASAYAMA | 2017 |
| Adsorption and charging of metal atoms in organic molecular solids | Kohei KAWABATA | 2017 |
| First-principles study on stability of boron clusters in BaSi2 | Akito NAGASAWA | 2017 |
| First-principles study of impurity, surface, and interface of BaSi2 | Yuki OSUGA | 2016 |
| Stability of metal atoms in insulator films; first-principles study | Yukiko ONDA | 2016 |
| Defects and Schottky barrier at metal/Ge interfaces; first-principles study | Shogo SASAKI | 2016 |
| Scattering processes of exciton polarons at organic semiconductor interfaces | Yoshimitsu MASUGATA | 2016 |
| Impurity state and electronic conductivity of organic semiconductors: first-principles study | Shingo TSUKUDA | 2015 |
| Diffusion and ionization of metal atoms around metal/SiO2 interfaces: first-principles study | Masaaki HIYAMA | 2015 |
| Quantum dissociation processes of exciton at semiconductor hetero-interfaces | Kosuke SATO | 2014 |
| Atom diffusion, segregation, and mixing at metal/semiconductor interfaces | Tomoki HIRAMATSU | 2014 |
| Metal-atom diffusion in self-assembled monolayer molecules | Kazuyuki YOSHIDA | 2014 |
| Theoretical study of loop currents in molecular bridge systems | Hideyuki IIZUKA | 2013 |
| Theoretical study of Schottky-barrier variation by structural disorder at metal/Si interfaces | Kyousuke KOBINATA | 2011 |
| Electronic structures of metal-atom adsorbed graphene | Tea-uk PARK | 2011 |
| First-principles study of stability and doping properties of silicides | Shinichi SOUTOME | 2010 |
| Stability and Schottky barrier of ultrathin-layer-inserted metal/Si interfaces | Yusuke MARUTA | 2010 |
| Electronic structures and dielectric properties of linked amino-acid systems | Yoh UMEBAYASHI | 2009 |
| Theory of quantum friction in nano-linked surface molecules | Yoichi SHIGENO | 2009 |
| Theoretical study of Schottky barrier modulation induced by interface layers | Hirotaka YUNO | 2009 |
| Theoretical study of electronic structures and stability of nickel silicides NixSiy | Sho SHINJI | 2008 |
| Effects of intra-molecular freedom on transient currents in nano-contact systems | Yoko TOMITA | 2008 |
| First-principle study of work functions at metal/La2O3 interfaces | Satoshi NISHIYAMA | 2008 |
| Correlation of bonding and Schottky barrier at metal/high-k oxide insulator interfaces | Ryuuichi AYUTA | 2007 |
| Study of physical properties of structural defects at metal/high-k oxide insulator interfaces | Harumichi NII | 2007 |
| Surface polarization effects on optical response spectra | Kazunori SHIBATA | 2006 |
| Electronic structure and stability of InN surfaces | Yuuki TAKEI | 2006 |
| First-principles Calculations on Chemical Trend of Intermixing at Metal/Semiconductor Interfaces | Satoshi ITAYA | 2005 |
| First-principles Study on Polarity Conversion Mechanism of AlN(0001) Surfaces | Jun MIKAMI | 2004 |
| Theoretical Study on Hole-induced Oxgen-defect Generation of Rutile-TiO2 Surfaces | Seiji KAJITA | 2004 |
| Numerical study of flat-band exiton in Kagome quantum-wire system | Hiroyuki ISHII | 2003 |
| Electronic structures of metalic-luster organic molecule crystals | Masato ODA | 2003 |
| Numerical simulation on generation and annihilation of macroscopic defects in silicon crystals | Ryo KOBAYASHI | 2003 |
| Electronic structures of screw-vacancy ƒÁ In2Se3 semiconductor | Kazushi FUJITA | 2003 |
| First-principles study of Au-Si intermixing mechanism on Si surfaces | Daiki MURAYAMA | 2002 |
| Origin of anisotropic Raman spectra in vacancy-ordered semiconductors | Kazuhisa OHMURA | 2001 |
| Monte Carlo simulation of ZnSe/GaA heterovalent-interface growth | Kazuaki SANO | 2000 |
| Numerical study on electric conductivity of mesoscopic systems based on non-equiliblium Green functions | Miki HIROSE | 2000 |
| Monte Carlo simulation of atom configuration in vacancy-ordered III2VI3 compounds | Takamitsu TAYAMA | 1999 |
| First-principles study on electronic structures of K2CuF4 under high pressure | Hideaki KOMODA | 1999 |
| Numerical study on lattice vibration of vacancy-ordered III2VI3 semiconductors | Namiko AOKI | 1998 |
| Numerical simulation of mis-valency effects on ZnSe/GaAs heteroepitaxial growth | Hitoshi TAKEUTI | 1998 |
| Photonic band structures of anisotropic materials | Hideki NISHIZAWA | 1996 |
| Electronic energy spectra of tight-binding lattice systems under magnetic field | Ichiro OIKAWA | 1994 |
| First-principles Calculation of Electronic Structures and Optical Properties of Semiconductor Hetero Systems | Misao MURAYAMA | 1993 |
| Effects of Interface Atomic Configurations on Electronic Structures of Semiconductor Superlattices | Katuya ODA | 1992 |