Publications in Lab
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Invited talk 招待講演
中西 寛（理事講演） 「水素に関わる反応触媒の探査 ー 物性物理学からのアプローチ ー」 2022年日本MRS水素科学技術連携研究会 2022年6月23,24日 on line 中西 寛（招待講演） 「合金触媒表面における水素化反応の理論計算」 第４回ハイドロジェノミクス研究会 2021年8月19-20日 on line Hiroshi Nakanishi (Invited Special Lecture) "Methane Dry Reforming Reaction and its coking-poisoning effects on Ni and Ru Stepped-Surfaces" 11th Asian Computational Materials Design Workshop 7-9 November, 2019, My Dinh campus, Vietnam Japan University, Hanoi, Vietnam Hiroshi Nakanishi (as special lecture) "Computaional catalysts simulation & design of methane activation Reaction." Asia Computational Materials Design Workshop 2018, Viet Nam 27-29 November, 2018, Thanh Tay Institute for Advanced Study – Thanh Tay University, Hanoi, Vietnam. Hiroshi Nakanishi (as special lecture) "Computational Catalysts Design for Methane Activation Reactions: DFT-based electronic state simulation & kinetic Monte Carlo reaction simulation" 10th Asian Computational Materials Design® (CMD) Workshop 18-20, September, 2018, De La Salle University, Philippines Hiroshi Nakanishi "DFT-Guided Design of Catalysts for Methane Activation" ICCMSE: International Conference of Computational Methods in Science and Engineering, "4th Computational Chemistry (CC) symposium" 15 March 2018, The Met Hotel, Thessalonki, Greece Hiroshi Nakanishi "Computational Materials Design and its applications: Creation of Artificial Rare Metal" 9th Asian Computational Materials Design® (CMD) Workshop 10-11, October, 2017, De La Salle University, Philippines Hiroshi Nakanishi "Inter-element Fusion Design for creating high performance material function" 3rd Computational Chemistry (CC) Symposium -The main symposium of ICCMSE 2017- 21-25, April, 2017, The Met Hotel, Thessalonki, Greece Ryan Arevalo "Catalysis of steam methane reforming" 2nd International Workshop on Quantum Materials Design for Nanotechnology Applications （Osaka university), 21-22, March, 2017, Osaka University Hiroshi Nakanishi "Quantum simulation for positive-muon and hydrogen isotope in materials" 2nd International Workshop on Quantum Materials Design for Nanotechnology Applications （Osaka university), 21-22, March, 2017, Osaka University Susan Menez Aspera "First Principles-based Studies of PdRuM (M=Rh, Ir, Ni, Ag) Ternary Metal Alloy Surfaces: Surface Segregation and Stability" 2nd International Workshop on Quantum Materials Design for Nanotechnology Applications （Osaka university), 21-22, March, 2017, Osaka University 中西 寛 （Hiroshi Nakanishi） 「電子・水素・イオン相関の理論と計算機シミュレーション」 “Theory and simulation of correlated motions between electrons, hydrogen atoms and ions” 日本物理学会 第72回年次大会（2017年）シンポジウム（領域10，領域3，領域8，ビーム物理領域）： 「電子・水素・イオンの動的複合相関を考慮した物質生命科学」 JPS 2017 Annual (72nd) Meeting, Symposium (R10,R3, R8, R Beam Physics): “Dynamic correlation among electrons, hydrogens, and ions in life and material science” 2017年3月17-20日 大阪大学 Hiroshi Nakanishi "Quantum simulation for the motion of positive-muon in materials and its application for Mu-SR spin state analysis " International workshop of computationalscience 2017 （IWSC2017, Kanazawa university), Special session of IWCS2017 "Design of Novel Magnetic Materials for Device Applications: Simulation and Experiment" 17-18, February, 2017, Kanazawa University Hiroshi Nakanishi "Quantum simulation of hydrogen isotope in materials and on their surfaces." The 2nd Korea-Japan Joint Symposium on Hydrogen in Materials 18–19 November,2016, Gachon University, Seongnam, Gyoung-gi-do, Korea. Hiroshi Nakanishi, Susan Menez Aspera, Ryan Lacdao Arevalo, Hideaki Kasai "Surface segregation effects on stability of nano-alloy particles" International Workshop on Advanced Materials and Nanotechnology (IWAMN 2016) 3-5 November 2016 - Hanoi, Vietnam 中西寛 「水素等質量の小さな原子と正ミュオンの第一原理シミュレーション」 第3回CUTEシンポジウム：コンピュータ化学「計算科学と実験科学の接点」 三重大学極限ナノエレクトロニクスセンター 2016年3月28日 三重大学 新産業創成研究拠点 Hiorshi Nakanishi "Stability Mechanism of Nano-alloy Particles: Toward the Theory of Inter-Element-Fusion Technology" Workshop on Computational Nano-Materials Design and Realization for Energy-Saving and Energy-Creation Materials March 25-26, 2016, Graduate School of Engineering Sciences, Osaka University, JAPAN 中西 寛 「表面・ナノマテリアル系スピントロニクス」 未来研究イニシアティブ「計算機ナノマテリアルデザイン新元素戦略」ワークショップ 〜ナノスピントロニクスのデザインと実証をめざして 2015年9月25―26日、 京都、国際高等研究所 中西 寛 「プローブ量子・正ミュオンの第一原理計算」 日本物理学会第７０回年次大会 シンポジウム講演 領域3,4,8,9,10合同 シンポジウム「第一原理計算手法の現状と展望」、 2015年3月21日、早稲田大学 早稲田キャンパス Hiroshi Nakanishi “Quantum states of impurity hydrogen isotopes in covalent crystals” the 10th International Conference on Diffusion in Solids and Liquids - DSL-2014 Paris, France, 23-27 Jun 2014 中西 寛、笠井秀明 「共有結合性結晶における不純物水素同位体の量子状態」 MSL ワークショップ「格子間水素同位体の位置と電子状態—酸化物を中心に」 2014年3月19日 エポカルつくば 日本 Hiroshi Nakanishi, Wilson Agerico Dino Tan, Hideaki Kasai "Quantum adsorbed states of hydrogen isotope atoms on graphene" International Workshop of Computational Nano-Materials Design on Green Energy, JSPS Core-to-Core Program Workshop Awaji Yumebutai International Conference Center, Japan, 16-19 June 2013 Hiroshi Nakanishi “Quantum simulation for hydrogen atom motion on solid surfaces” Workshop on Physics of Hydrogen in Materials, 2012/01/30-31, ISIR, Osaka University, Osaka, JAPAN 中西 寛 「ミュオンがみる固体表面・サブ表面」 日本物理学会2011年秋季大会 シンポジウム講演 領域10 シンポジウム「超低速ミュオン顕微鏡：その限りない可能性を探る」 2011年09月21-24日 富山大学、日本 中西 寛、笠井秀明 「Pd表面上でのミューオンと水素の量子吸着状態」 第9回水素量子アトミクス研究会 2011年08月22-23日 東北大学金属材料研究所、日本 中西 寛 「物質環境下におけるミュオン量子状態の第一原理計算」 ワークショップ「超低速ミュオン顕微鏡」 2011年05月29-30日 東京工業大学、日本 中西 寛 “プロトン・ミュオンのための次世代第一原理計算手法” 東北大通研共同プロジェクト研究「次世代第一原理計算手法の開発•応用」 2010年11月10-11日 東北大学電気通信研究所、日本 中西 寛 “磁性制御による表面反応デザインと量子ダイナミクス” 山田科学振興財団 新規プログラム（若手研究者の分野交錯研究推進プログラム）研究会 「ナノスケールの原子構造および電子状態とその変化の理論的設計」 2010年8月31日-9月1日 国際高等研究所、日本 Hiroshi Nakanishi “Computational Materials Design of Molecular Bridge Systems for Potential Applications as Nano-Electronics Devices” International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR 30th May- 4th June, 2010 Osaka, Japan Hiroshi Nakanishi “Theoretical study of the hydrogen absorption on the Pd surface” 日本物理学会2008年秋季大会シンポジウム （領域9，領域10合同） “Physics and applications of hydrogen absorption on Pd surfaces and nano particles” 2008年9月20日 岩手大学 Hiroshi Nakanishi "Atom scale dynamics in fuel cell and computational materials design (CMD)" Asian Physics Symposium 2007 - The 2nd Asian Physics Symposium - 29-30 November 2007 , Bandung, Indonesia 中西 寛 “磁性原子細線の物性 －構造・磁性・スピン編極電流－” 日本物理学会2002年秋季大会 特別講演 2002年9月7日 中部大学、日本 Hiroshi Nakanishi, Hideaki Kasai, Ayao Okiji “Magnetic properties and structure stability of ladder atom bridge made of iron” INTERNATIONAL WORKSHOP ON "Dynamical Phenomena Related with Electrons at Surfaces" (Dyna-PRESS) 27th IUVSTA Workshop, January, 2001, Kushiro, Japan Hiroshi Nakanishi, Yuji Morigaki, Hideaki Kasai, Ayao Okiji “Quantum transport properties in atom-sized bridges of magnetic” The Third SANKEN International Symposium on Advanced Nanoelectronics: Devices, Materials, and Computing, "Advanced Nanoelectronics: Devices, Materials, and Computing", March, 2000, Osaka, Japanto TOP
International Conference 国際会議発表
2022
Hiroshi Nakanishi, Susan Meñez Aspera, Ryan Lacdao Arevalo, Hideaki Kasai "Estimation of metal surface oxidation resistance by ab initio thermodynamics calculation" THE 22ND INTERNATIONAL VACUUM CONGRESS IVC-22 11-16, September 2022, Sapporo Convention Center, Sapporo, Japan Ryan Lacdao Arevalo, Susan Menez Aspera, Hideaki Kasai, Hiroshi Nakanishi "Carbon Conversion under Steam Reforming Environment: Influence of Surface-Bound Oxidants on Reaction Path" THE 22ND INTERNATIONAL VACUUM CONGRESS IVC-22 11-16, September 2022, Sapporo Convention Center, Sapporo, Japan Susan Menez Aspera, Ryan Lacdao Arevalo, Hideaki Kasai, Hiroshi Nakanishi "Kinetic studies of methane decomposition and dry refroming on Ni-based stepped surfaces" THE 22ND INTERNATIONAL VACUUM CONGRESS IVC-22 11-16, September 2022, Sapporo Convention Center, Sapporo, Japan Jeffrey Tanudji, Hideaki Kasai, Michio Okada, Tetsuo Ogawa, Susan Meñez Aspera, Hiroshi Nakanishi " Comparison of Astatine and Iodine adsorption on Au(111) surface" THE 22ND INTERNATIONAL VACUUM CONGRESS IVC-22 11-16, September 2022, Sapporo Convention Center, Sapporo, Japan Jeffrey Tanudji, Hideaki Kasai, Michio Okada, Tetsuo Ogawa, Susan Meñez Aspera, Hiroshi Nakanishi "Adsorption of Iodine on Au(111) surface: coverage effect" THE 22ND INTERNATIONAL VACUUM CONGRESS IVC-22 11-16, September 2022, Sapporo Convention Center, Sapporo, Japan2021
Hiroshi Nakanishi, Susan Meñez Aspera, Ryan Lacdao Arevalo, Hideaki Kasai "Surface Kinetics of Catalysis for Methane Activation" The 9th International Symposium on Surface Science(ISSS9) November 28 to December 1, 2021, online from JAPAN Hiroshi Nakanishi, Susan Meñez Aspera, Ryan Lacdao Arevalo, Hideaki Kasai "An International Graduate‐School-Level Collaborative Program in NIT Akashi on Cutting Edge Research andProject Developments" 14th International Symposium on Advances in Technology Education (ISATE2021) 17-20 August 2021, ONLINE from Turku, Finland Susan Meñez Aspera, Ryan Lacdao Arevalo, Bhume Chantaramolee, Hiroshi Nakanishi, Hideaki Kasai "PdRuIr Ternary Alloy as an Effective NO Reduction Catalyst: Insights from first-principles calculation" APS March Meeting 2021 15-19 March 2021 on-line2020
Ryan Lacdao Arevalo, Susan Menez Aspera, Roland Emerito Otadoy, Hiroshi Nakanishi, Hideaki Kasai "Role of water dissociation kinetics on Ni-catalyzed atomic carbon conversion in a steam reforming environment: Which path to take?" Samahang Pisika ng Pilipinas National Convention 19-23 October 2020 online SPP Physics Conference2019
Hiroshi Nakanishi【招待特別講義】 "Methane Dry Reforming Reaction and its coking-poisoning effects on Ni and Ru Stepped-Surfaces" 11th Asian Computational Materials Design Workshop 7-9 November, 2019, My Dinh campus, Vietnam Japan University, Hanoi, Vietnam Hiroshi Nakanishi, Ryan Lacdao Arevalo, Susan Menez Aspera, Hideaki Kasai "Ab initio kinetic Monte Carlo simulation analysis of methane dry reforming on stepped Ru and Ni Surfaces for cokingresistance-catalysts design" IVC-21 (21st International Vacuum Congress) 1-5 July 2019, Malmo, Sweden2018
Hiroshi Nakanishi 【特別講義】 "Computaional catalysts simulation & design of methane activation Reaction." Asia Computational Materials Design Workshop 2018, Viet Nam 27-29 November, 2018, Thanh Tay Institute for Advanced Study – Thanh Tay University, Hanoi, Vietnam. Hiroshi Nakanishi 【招待講義】 "Computational Catalysts Design for Methane Activation Reactions: DFT-based electronic state simulation & kinetic Monte Carlo reaction simulation" 10th Asian Computational Materials Design® (CMD) Workshop 18-20, September, 2018, De La Salle University, Philippines Ryan Lacdao AREVALO, Susan Menez ASPERA, Hideaki KASAI, Hiroshi NAKANISHI, Syo MATSUMURA "Methane activation on Ni surface: DFT-based insights into catalyst design" The 8th Tokyo Conference on Advanced Catalytic Science and Technology (TOCAT8) Yokohama JAPAN, Japan, 5-10 August 2018 Susan Meñez Aspera, Ryan Arevalo, Hiroshi Nakanishi "On Understanding Ternary Alloys: Third-Metal Effect of PdRuM (M=Rh,Ir) on NO Reduction" Japan-Germany Joint Symposium on Advanced Catalytic Materials and Characterization TUM Catalysis Research Center, Munich, Germany, 19-21 June 2018 Ryan Arevalo, Susan Meñez Aspera, Hiroshi Nakanishi "DFT-guided design of non-coking Ni-based catalysts for methane reforming" Japan-Germany Joint Symposium on Advanced Catalytic Materials and Characterization TUM Catalysis Research Center, Munich, Germany, 19-21 June 2018 Ryan Arevalo, Susan Meñez Aspera, Hiroshi Nakanishi "Rational Design of Catalysts for Borhydride Oxidation: Insights from DFT" Japan-Germany Joint Symposium on Advanced Catalytic Materials and Characterization TUM Catalysis Research Center, Munich, Germany, 19-21 June 2018 Hiroshi Nakanishi "DFT-Guided Design of Catalysts for Methane Activation" ICCMSE: International Conference of Computational Methods in Science and Engineering, "4th Computational Chemistry (CC) symposium" The Met Hotel, Thessalonki, Greece, 15 March 2018【招待】to TOP 2017
Hiroshi Nakanishi "Computational Materials Design and its applications: Creation of Artificial Rare Metal" 9th Asian Computational Materials Design® (CMD) Workshop De La Salle University, Philippines, 10-11, October, 2017 【招待・基調講演】 Ryan Arevalo, Susan Meñez Aspera, Mary Clare Sison Escano, Hiroshi Nakanishi, Hideaki Kasai "Tuning methane decomposition on stepped Ni surface: Role of subsurface atoms in catalyst design" 9th Asian Computational Materials Design® (CMD) Workshop De La Salle University, Philippines, 10-11, October, 2017 Susan Meñez Aspera, Ryan Arevalo, Hiroshi Nakanishi, Hideaki Kasai "Tuning methane decomposition on stepped Ni surface: Role of subsurface atoms in catalyst design" 9th Asian Computational Materials Design® (CMD) Workshop De La Salle University, Philippines, 10-11, October, 2017 Ryan Arevalo, Susan Meñez Aspera, Mary Clare Sison Escano, Hiroshi Nakanishi, Hideaki Kasai "How do Ru and Ni surfaces catalyze methane decomposition: New insights for catalyst design" Americal Chemical Society 254th National Meeting and Convention Walter Washington Convention Center, 20-25, August, 2017 Hiroshi Nakanishi, Ryan Lacdao Arevalo, Susan Meñez Aspera, Hideaki Kasai "COMPUTATIONAL MATERIALS DESIGN OF VIRTUAL NOBLE METALS" Joint UK-Japan Symposium on Nanomaterials, Catalysis and Hydrogen Research University of Kent, UK, 3-5, July, 2017 Ryan Lacdao Arevalo, Hiroshi Nakanishi, Susan Meñez Aspera, Hideaki Kasai "How do Ru and Ni surfaces catalyze methane decomposition? - New insights for catalyst design -" Joint UK-Japan Symposium on Nanomaterials, Catalysis and Hydrogen Research University of Kent, UK, 3-5, July, 2017 Susan Meñez Aspera, Ryan Arevalo, Hiroshi Nakanishi, Hideaki Kasai "2D materials for fuel cell: functionalization of graphitic carbon nitride for oxygen reduction reaction (ORR) application" Joint UK-Japan Symposium on Nanomaterials, Catalysis and Hydrogen Research University of Kent, UK, 3-5, July, 2017 Ryan Arevalo, Susan Meñez Aspera, Hiroshi Nakanishi, Hideaki Kasai "Catalysis of Steam Methane Reforming: From Electronic Properties to Thermodynamics" Importanne Hotels and Resort, Dubrovnik, Croatia. 3-7 May 2017 Hiroshi Nakanishi "Inter-element Fusion Design for creating high performance material function" 3rd Computational Chemistry (CC) Symposium -The main symposium of ICCMSE 2017- The Met Hotel, Thessalonki, Greece, 21-25 April, 2017 【招待】 Hiroshi Nakanishi, Ryan Lacdao Arevalo, Susan Menez Aspera, Hideaki Kasai "Quantum simulation for positive-muon and hydrogen isotope in materials" 2nd International Workshop on Quantum Materials Design for Nanotechnology Applications Osaka University, Suita Campus, 21-22 March 2017 Susan Meñez Aspera, Ryan Arevalo, Hiroshi Nakanishi, Hideaki Kasai "First Principles-based Studies of PdRuM (M=Rh, Ir, Ni, Ag) Ternary Metal Alloy Surfaces: Surface Segregation and Stability" 2nd International Workshop on Quantum Materials Design for Nanotechnology Applications Osaka University, Suita Campus, 21-22 March 2017 Ryan Lacdao Arevalo, Susan Menez Aspera, Mary Clare Sison Escano, Hiroshi Nakanishi, Hideaki Kasai "Catalysis of steam methane reforming" 2nd International Workshop on Quantum Materials Design for Nanotechnology Applications Osaka University, Suita Campus, 21-22 March 2017 Susan Meñez Aspera, Ryan Arevalo, Hiroshi Nakanishi, Hideaki Kasai "Surface segregation and stability of PdRuM (M=Rh, Ir, Ni, Ag) ternary metal alloy surfaces through first principles-based studies" American Physical Society (APS) March Meeting 2017, New Orleans, Lousiana, USA, 13-17, March, 2017, Hiroshi Nakanishi "Quantum simulation for the motion of positive-muon in materials and its application for Mu-SR spin state analysis" International workshop of computationalscience 2017 （IWSC2017, Kanazawa university), Special session of IWCS2017 "Design of Novel Magnetic Materials for Device Applications: Simulation and Experiment" Kanazawa University, 17-18, February, 2017 【招待】to TOP 2016
Hiroshi Nakanishi Quantum simulation of hydrogen isotope in materials and on their surfaces. The 2nd Korea-Japan Joint Symposium on Hydrogen in Materials Gachon University, Seongnam, Gyoung-gi-do, Korea, 18–19, November,2016,【招待】 Hiroshi Nakanishi, Susan Menez Aspera, Ryan Lacdao Arevalo, Hideaki Kasai Surface segregation effects on stability of nano-alloy particles International Workshop on Advanced Materials and Nanotechnology (IWAMN 2016) Hanoi, Vietnam, 3-5, November 2016 【招待】 Hiorshi Nakanishi, Susan Meñez Aspera, Ryo Kishida, Koji Shimizu, Kazuki Kojima, Nguyen Hoang Linh, Hideaki Kasai "Stability mechanism of nano-alloy particles: Toward the theory of Inter-Element-Fusion Technology" 2016 Japan-Germany Joint Symposium on Advanced Characterization of Nanostructured Materials for Energy and Environment Düsseldorf, Germany, June 27-30,2016. Mary Clare S. Escano, Hiroshi Nakanishi, Hidaek Kasai, "Reactivity mechanism in carbon due to metal effects" 2016 Japan-Germany Joint Symposium on Advanced Characterization of Nanostructured Materials for Energy and Environment Düsseldorf, Germany, June 27-30,2016. Susan Menez Aspera, Koji Shimizu, Kazuki Kojima, Ryo Kishida, Nguyen Hoang Linh, Hiroshi Nakanishi, Hideaki Kasai "Surface Effects on Bimetallic Alloys: Palladium-Iridium Case" (Poster) 2016 Japan-Germany Joint Symposium on Advanced Characterization of Nanostructured Materials for Energy and Environment Düsseldorf, Germany, June 27-30,2016. R. Kishida, Susan Menez Aspera, Hiroshi Nakanishi, Hideaki Kasai "Surface structures of bimetallic systems: PdAg and PdRh" (Poster) 2016 Japan-Germany Joint Symposium on Advanced Characterization of Nanostructured Materials for Energy and Environment Düsseldorf, Germany, June 27-30,2016. Hiorshi Nakanishi "Stability Mechanism of Nano-alloy Particles" Workshop on Computational Nano-Materials Design and Realization for Energy-Saving and Energy-Creation Materials Graduate School of Engineering Sciences, Osaka University, JAPAN, 25-26 March, 2016, 【招待】to TOP 2015
Hiroshi Nakanishi “Quantum simulations for hydrogen isotope in materials” the 11th International Conference on Diffusion in Solids and Liquids - DSL-2015, Munich, Germany, 22-26 Jun 2015to TOP 2014
Hiroshi Nakanishi ”Quantum states of positive-muon and proton in materials” The 2nd International Symposium on Computics: Quantum Simulation and Design. ISC-QSD2014 Tokyo, JAPAN,1-3 Dec. 2014 Hiroshi Nakanishi “Quantum states of impurity hydrogen isotopes in covalent crystals” the 10th International Conference on Diffusion in Solids and Liquids - DSL-2014 Paris, France, 23-27 Jun 2014 【招待】 Hiroshi Nakanishi “Atom scale dynamics in fuel cell and computational materials design (CMD)” International Workshop of Computational Nano-Materials Design on Green Energy Osaka University, Japan, 1-3 Jun 2014to TOP 2013
Hiroshi Nakanishi, Hideaki Kasai "Quantum states of proton and positive muon on solid surfaces and in subsurfaces" The IVC-19/ICN+T 2013/ICSS-15/ITFPC 2013/MIATEC 2013/CIP 2013/RSD 2013 Congress, Paris, France, 9-13 September 2013 Hiroshi Nakanishi, Hideaki Kasai "Quantum states of positive muon in materials" International Symposium on Science Explored by Ultra Slow Muon Microscope (USM2013) Matsue, Japan, 9-12 August 2013. Hiroshi Nakanishi, Wilson Agerico Dino Tan, Hideaki Kasai "Quantum adsorbed states of hydrogen isotope atoms on graphene" International Workshop of Computational Nano-Materials Design on Green Energy, JSPS Core-to-Core Program Workshop Awaji Yumebutai International Conference Center, Japan, 16-19 June 2013 【招待】 Hiroshi Nakanishi, Hideaki Kasai "Quantum adsorbed states of positive muon and hydrogen atom on graphene" Graphene Week 2013, Chemnitz, Germany, 2-7 June 2013to TOP 2012
Allan Abraham B. Padama, Koji Shimizu, Yuji Kunisada, Hiroshi Nakanishi, Hideaki Kasai "The Variation of Work Function in Cs-W(110) System at Different Cs Coverage: A Density Functional Theory Study" 5th International Symposium on Atomically Controlled Fabrication Technology Osaka Univ. Nakanoshima Center, Japan, 22-24 October 2012 Yuji. Kunisada, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Ortho-Para H2 Conversion on Ag(111): DFT-D2 Study" 5th International Symposium on Atomically Controlled Fabrication Technology Osaka Univ. Nakanoshima Center, Japan, 22-24 October 2012 Kohei Oka, Hiroshi Nakanishi, Hideaki Kasai "Prediction about piezoelectric behavior of Pb(Zr,Ti)O3, Sn(Zr,Ti)O3, Ge(Zr,Ti)O3" 5th International Symposium on Atomically Controlled Fabrication Technology Osaka Univ. Nakanoshima Center, Japan, 22-24 October 2012 Tien Quang Nguyen, Mary Clare Sison Escaño, Hiroshi Nakanishi, Hideaki Kasai "O2 adsorption and dissociation on CeO2-supported Pt nanoparticles: A DFT+U Study" 5th International Symposium on Atomically Controlled Fabrication Technology Osaka Univ. Nakanoshima Center, Japan, 22-24 October 2012 Yuji Kunisada, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Effect of H2 Diffusion on the ortho-para H2 Conversion on the O2/Ag(111) system" International symposium on metal-hydrogen systems -fundamentals and applications- Kyoto, Japan, 21-26 October 2012 Hideaki Kasai, Wilson Agerico Diño, Hiroshi Nakanishi "Computational Materials Design from basics to real applications" International Symposium on Computics: Quantum Simulation and Design (ISC-QSD) Osaka University, Japan, 11-13 October 2012 Hiroshi Nakanishi, Hideaki Kasai "Quantum simulation for proton and muon on solid surfaces and in subsurfaces" International Symposium on Computics: Quantum Simulation and Design (ISC-QSD) Osaka University, Japan, 11-13 October 2012 Allan Abraham B. Padama, Koji Shimizu, Yuji Kunisada, Hiroshi Nakanishi, Hideaki Kasai "First principles investigation of work function variation in Cs-W(110) system at different Cs coverage" International Symposium on Computics: Quantum Simulation and Design (ISC-QSD) Osaka University, Japan, 11-13 October 2012 Yuji Kunisada, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Effects of H2 Hindered Rotational States on the Ortho-Para H2 Conversion on Ag(111)" International Symposium on Computics: Quantum Simulation and Design (ISC-QSD) Osaka University, Japan, 11-13 Octorber 2012 Mary Clare Escaño, Tien Quang Nguyen, Hiroshi Nakanishi, Hideaki Kasai "Effects of Spin-polarization of Pt on Oxygen Dissociative Adsorption" International Symposium on Computics: Quantum Simulation and Design (ISC-QSD) Osaka University, Japan, 11-13 Octorber 2012 Kohei Oka, Hiroshi Nakanishi, Hideaki Kasai "The substitution influence on the ferroelectrics about Pb(Zr,Ti)O3" International Symposium on Computics: Quantum Simulation and Design (ISC-QSD) Osaka University, Japan, 11-13 October 2012 Triati Dewi Kencana Wungu, Susan Meñez Aspera, Musa Alaydrus, Tran Linh, Mamoru Sakaue, Shinichi Kunikata, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai, Tatsumi Ishihara "First Principles Study on the Oxygen-Vacancy Migration in LaGaO3" 28th European conference on surface science Scotland, United Kingdom, 3-7 September 2012 Mary Clare Escaño, Tien Quang Nguyen, Hiroshi Nakanishi, Hideaki Kasai "Oxygen adsorption on ferromagnetic platinum" 28th European conference on surface science Scotland, United Kingdom, 3-7 September 2012to TOP 2011
Hiroshi Nakanishi "The first principles simulation code for the muon and proton on the solid surface, in the subsurface and bulk" Quantum Simulations and Design International Focus Workshop Dresden, Germany, 27-29 September 2011 Yuji Kunisada, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Magnetic Ordered States Induced by O2 Adsorption on Ag(111)" 28th European Conference on Surface Science, ECOSS28 Wroclaw, Poland, 28 August-2 September 2011to TOP 2010
Emi Minamitani, Kuniyuki Miwa, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Two-impurity Kondo Effect on Surface -Magnetic Field and Temperature dependence-" Condensed Matter and Material Physics, CMMP10 Coventry, United Kingdom, 14-16 December 2010 Emi Minamitani, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Two-impurity Kondo effect on solid surfaces -differential conductance mapping image calculations-" Third International Symposium on Atomically Controlled Fabrication Technology Osaka University Nakanoshima Centor, Osaka, 24-26 November 2010 Yuji Kunisada, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "The Effects of Coadsorbed O2 Molecule on Nuclear Spin Conversion of H2 Molecule on the Ag(111) Surface" Third International Symposium on Atomically Controlled Fabrication Technology Osaka University Nakanoshima Centor, Osaka, 24-26 November 2010 Wungu Triati Dewi Kencana, Dipojono Hermawan Kresno, Hiroshi Nakanishi, Hideaki Kasai "Atomistic Modelling of Montmorillonite Based on First Principles Calculations" Third International Symposium on Atomically Controlled Fabrication Technology Osaka University Nakanoshima Centor, Osaka, 24-26 November 2010 Masanori Tani, Mamoru Sakaue, Hiroshi Nakanishi, Wison Agerico Diño, Hideaki Kasai "First Principle Calculation of C7H12ON+ Cation Adsorption on Graphene" Third International Symposium on Atomically Controlled Fabrication Technology Osaka University Nakanoshima Centor, Osaka, 24-26 November 2010 Emi Minamitani, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Two-impurity Kondo effect under a magnetic field in surface systems" The 6th International Workshop on Nano-scale Spectroscopy and Nanotechnology Kobe University Centennial Hall, Kobe, 25-29 October 2010 Abdulla Sarhan, Hiroshi Nakanishi, Hideaki Kasai "Modeling of Electron Transport through Adsorbed Melamine Molecule on Cu(100) Surface" The 27th European Conference on Surface Science Groningen, the Kingdom of the Netherlands, 29 August-3 September 2010 Hiroshi Nakanishi "Computational Materials Design of Molecular Bridge Systems for Potential Applications as Nano-Electronics Devices" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 【招待】 Emi Minamitani, Nghiem Hoa ThiMinh, Kuniyuki Miwa, Kazuki Kojima, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Real Space Imaging of the Kondo Effect and the RKKY Interaction -STS observation of spin correlation on a metal surface-" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 Handoko Setcho Kuncoro, Melanie David, Hiroshi Nakanishi, Hideaki Kasai, Hermawan Kresno Dipojono, Eben Sy Dy "A DFT investigation on the volumes, the dehydration energies and the rotational barriers of Ca2+ cation contaminant on small water cluster system" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 Yuji Kunisada, Hiroshi Nakanishi, Wilson A. Diño, Hideaki Kasai "Mechanism of Nuclear Spin Conversion of H2 Molecules with Coadsorbed O2 Molecules on Metal Surfaces" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 Mary Clare S. Escaño, Elod L. Gyenge, Hiroshi Nakanishi, Hideaki Kasai "Enhancing Gas-Bimetallic Surface Reaction via Spin Manipulation" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 Susan M. Aspera, Melanie Y. David, Hiroshi Nakanishi, Hideaki Kasai, Hiroyuki Kawai "First Principles Study of O2 Adsorption and Dissociation on Graphitic Carbon Nitride (g-C3N4)" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 Masanori Tani, Mamoru Sakaue, Hiroshi Nakanishi, Hideaki Kasai, Masatoshi Uetani, Akinori Oka "Theoretical study of C7H12ON+ cation adsorption on graphene" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010 Tien Quang Nguyen, Hiroshi Nakanishi, Hideaki Kasai "Theoretical Study on The Adsorption of NO on Metal Phthalocyanines for Biosensor Application" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR, Osaka University Convention Center, Osaka, 30 May-4 June 2010 Abdulla Sarhan, Hiroshi Nakanishi, Hideaki Kasai "Current Switching in Naphthalocyanine and Resistance Switching in ReRAM: Physical Approach to Logical Processes" International Conference on Core Research and Engineering Science of Advanced Materials (Global COE Program) & Third International Conference on Nanospintronics Design and Realization, 3rd-ICNDR Osaka University Convention Center, Osaka, 30 May-4 June 2010to TOP 2009
Tien Quang Nguyen, Mary Clare Sisson Escaño, Shinichi Kunikata, Hiroshi Nakanishi, Hideaki Kasai, Hiroyoshi Maekawa, Kazuo Osumi, Yoshihisa Tashiro "DFT Study of Oxygen Vacancy Formation in A Diesel Oxidation Catalyst: Pt/CeO2(111)" AVS 56th International Symposium and Exhibition San Jose, U.S.A, 8-13 November 2009 Nobuki Ozawa, Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Quantum dynamics of a hydrogen atom into the Pd(111) subsurface" The 11th ISSP International Symposium (ISSP-11) on Hydrogen and Water in Condensed Matter Physics Chiba, Japan, 12-16 October 2009 Do Ngoc Son, Melanie David, Hiroshi Nakanishi, Hideaki Kasai "Oxygen Reduction in Presence of Hydronium Ion on Pt(111) surface" The 11th ISSP International Symposium (ISSP-11) on Hydrogen and Water in Condensed Matter Physics Chiba, Japan, 12-16 October 2009 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Hydrogen interaction with graphene and platinum: a computational perspective" The 11th ISSP International Symposium (ISSP-11) on Hydrogen and Water in Condensed Matter Physics Chiba, Japan, 12-16 October 2009 Handoko Setyo Kuncoro, Rachid Belkada, Melanie David, Eben Sy Dy, Hiroshi Nakanishi, Hermawan Kresno Dipojono, Hideaki Kasai "A Theoretical Study on the Formation and Binding Energies of Small Water Cluster Systems" The 11th ISSP International Symposium (ISSP-11) on Hydrogen and Water in Condensed Matter Physics Chiba, Japan, 12-16 October 2009 Emi Minamitani, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Observation of the two-impurity Kondo effect in the STS spectra" 11th International Conference on Electronic Spectroscopy and Structure(ICESS11) Nara, Japan, 6-10 October 2009 Nghiem Thi Minh Hoa, Melanie David, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Kondo resonance and magnetic properties of two magnetic atoms on a metal surface: QMC simulation" 11th International Conference on Electronic Spectroscopy and Structure(ICESS11) Nara, Japan, 6-10 October 2009 Melanie David, Hiroshi Nakanishi, Hideaki Kasai "Adsorption of carbon nanotubes on transition metal surfaces - a DFT-based study" 20th European Conference on Diamond, Diamond- Like Materials, Carbon Nanotubes, and Nitrides, Athens, Greece, 6-10 September 2009 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai, Kunihiro Nobuhara, Tsuyoshi Sugimoto, Kyouichi Tange "Saturating graphene with chemisorbed hydrogen" 20th European Conference on Diamond, Diamond- Like Materials, Carbon Nanotubes, and Nitrides Athens, Greece, 6-10 September 2009 Nobuki Ozawa, Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Quantum dynamics behaviors of a hydrogen atom near the surfaces of bulk and crystalline Pd" The 26th European Conference On Surface Science(ECOSS26) Parma, Italy, 31 August-4 September 2009 Emi Minamitani, Yuji Kunisada, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "STS Observation of the Interference between the Kondo effects and spin correlation effects by the RKKY interaction" The 26th European Conference On Surface Science(ECOSS26) Parma, Italy, 31 August-4 September 2009 Yuji Kunisada, Hirofumi Kishi, Fajarisandi Dimas, Hiroshi Nakanishi, Hideaki Kasai, Takuma Asari, Shigeo Hayashi "Adsorption properties of BF4- anions on graphene sheet" The 26th European Conference On Surface Science(ECOSS26) Parma, Italy, 31 August-4 September 2009 Yoshiyuki Kubota, Hiroshi Nakanishi, and Hideaki Kasai "Ab initio calculations on lithium-graphite intercalation compounds" Carbon2009 Biarritz, France, 14-19 June 2009 Yuji Kunisada, Hirofumi Kishi, Fajarisandi Dimas, Hiroshi Nakanishi, Hideaki Kasai, Takuma Asari, Shigeo Hayashi "Adsorption properties of BF4- anions on graphene" International Symposium on Carbon Nanotube Nanoelectronics Matsushima, Miyagi, Japan, 9-12 June 2009to TOP 2008
Nelson B. Arboleda Jr., Hideaki Kasai, Hiroshi Nakanishi, Tanglaw Roman, Tsuyoshi Sugimoto, Kyouichi Tange, Kunihiro Nobuhara "First Principles Studies on the Absorption of H on Graphite via the Armchair edge" The 4th Vacuum and Surface Sciences Conference of Asia and Australia (VASSCAA-4) Shimane, JAPAN, 28 - 31 October 2008 Hiroshi Nakanishi, Hideaki Kasai, Kunihiro Nobuhara, Tsuyoshi Sugimoto, Kyouichi Tange "Hydrogen storage on Ni(111) surface" The 4th Vacuum and Surface Sciences Conference of Asia and Australia (VASSCAA-4) Shimane, JAPAN, 28 - 31 October 2008 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Coadsorbed H and CO interaction on Pt(111)" The 4th Vacuum and Surface Sciences Conference of Asia and Australia (VASSCAA-4) Shimane, JAPAN, 28 - 31 October 2008 Emi Minamitani, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "The real space imaging of double impurity Kondo problem" The 4th Vacuum and Surface Sciences Conference of Asia and Australia (VASSCAA-4) Shimane, JAPAN, 28 - 31 October 2008 Nobuki Ozawa, Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "A systematic study of hydrogen atom behaviors on various Pd alloy surfaces with the aid of the first principles calculations" The 4th Vacuum and Surface Sciences Conference of Asia and Australia (VASSCAA-4) Shimane, JAPAN, 28 - 31 October 2008 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "A closer look at H-CO interaction on the platinum surface" AVS 55th International Symposium and Exhibition Boston, U.S.A, 19 - 24 October 2008 Hirofumi Kishi, Hiroshi Nakanishi, Hideaki Kasai, Masashi Taniguchi, Mari Uenishi, Hirohisa Tanaka, Yasuo Nishihata, Jun’ichiro Mizuki "Structural properties of vacancies in Pd-based perovskite catalysts for automotive emissions control" Surface and Interface Processes at the Molecular Level Il Ciocco Conference Centre, Nr. Lucca, Italy, 17-23 August 2008 Emi Minamitani, Hiroshi Nakanishi, Wilson Agerico Diño , Hideaki Kasai "The competition between Kondo effects and localized spin-spin interaction effects on scanning tunneling spectroscopy" the 25th International Conference on Low temperature Physics Amsterdam , Netherlands, 6 - 13 August 2008 Melanie David, Koichiro Kasai, Hiroshi Nakanishi, Hideaki Kasai "Diameter dependence of single-walled carbon nanotube on Ti(0001)" International Conference on Nanoscience and Technology Keystone, USA, 21 - 25 July 2008 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Quantum simulation case studies for solid surface-bound hydrogen atom states: potential energy treatment for H on Pt" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Mary Clare Sison Escaño, Hiroshi Nakanishi, Hideaki Kasai "Alternative PEFC cathode catalyst design by first principles" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Joaquin Moreno, Koichiro Kasai, Melanie David, Hiroshi Nakanishi, Hideaki Kasai, Shinichi Matsumoto, Shigeaki Murata, Hirosyuki Kawai "Hydrogen peroxide adsorption on Fe-filled single-walled carbon nanotubes: a theoretical study" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Emi Minamitani, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Observing the Kondo Effect using low temperature STM- Numerical Renormalization Group Studies -" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Nguyen Tien Quang, Reiko Tanaka, Hiroshi Nakanishi, Hideaki Kasai "Adsorption of NO on various metal tape-porphyrin by first principles study" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Hiroshi Nakanishi, Hideaki Kasai, Kunihiro Nobuhara, Tsuyoshi Sugimoto, Kyouichi Tange "Hydrogen storage in nano-pores on metal surfaces" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Kourou Fujio, Tanglaw Roman, Mary Clare Sison Escaño, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Quantum dynamics of the dissociative adsorption of O2 on monolayer Pt covered Fe(001) surface" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Quantum simulation case studies for solid surface-bound hydrogen atom states: potential energy treatment for H on Pt" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Abdulla Sarhan , Nelson B. Arboleda Jr. , Hiroshi Nakanishi, Hideaki Kasai "STM-Induced Switching of Hydrogen molecule in Naphthalocyanine" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Agusta Mohammad Kemal, Melanie David, Hiroshi Nakanishi,Hideaki Kasai "SO3 structure and formation on Cu(100) : density functional theory investigation" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Nobuki Ozawa, Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "A theoretical study on quantum behaviors of a hydrogen atom on the Pd and Pd alloy surfaces" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008 Do Ngoc Son, Hiroshi Nakanishi, Hideaki Kasai "A study of reactions on the Platinum (111) cathode surface of fuel cells" International Conference on Quantum Simulators and Design (QSD2008) Tokyo, Japan, 31 May - 4 June 2008to TOP 2007
Hiroshi Nakanishi, Hideaki Kasai "Atom scale dynamics in fuel cell and computational materials design (CMD)" Asian Physics Symposium 2007 - The 2nd Asian Physics Symposium - Bandung, Indonesia, 29-30 November 2007【招待】 Hirofumi Kishi, David Melanie, Roman Tanglaw, Hiroshi Nakanishi, Hideaki Kasai, Fumiyoshi Takano, Hisashi Shima, Hiro Akinaga "Density functional theory calculation based reactive ion etching (RIE) process model for TiO2(anatase) thin film" 9th International Conference on Atomically Controlled Surfaces, Interfaces and Nanostructures Tokyo, Japan, 11-15 November 2007 Nobuki Ozawa, Nelson B. Arboleda Jr., Hiroshi Nakanishi, Hideaki Kasai "Theoretical study of hydrogen atom behaviors on the Pd(111) surface and in its subsurface via quantum dynamical manners" IVC-17/ICSS-13 and ICN+T 2007 Congress Stockholm, Sweden, 2-6 July 2007 Nelson Arboleda Jr., Hideaki Kasai, Tanglaw Roman, Hiroshi Nakanishi "First Principles Calculations of the Vacancy Effects on the Dissociative Adsorption of H2 on Pt(111) Surface" IVC-17/ICSS-13 and ICN+T 2007 Congress Stockholm, Sweden, 2-6 July 2007 Melanie David, Tomoya Kishi, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Magnetic and electronic calculations of single-wall carbon nanotubes filled with TM on metal surfaces" IVC-17/ICSS-13 and ICN+T 2007 Congress Stockholm, Sweden, 2-6 July 2007 Tanglaw Roman, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Dynamics of halogen-assisted Cu atom abstraction from Cu(111) and CuO(100)" IVC-17/ICSS-13 and ICN+T 2007 Congress Stockholm, Sweden, 2-6 July 2007 Emi Minamitani, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "The effect of the spin states of two magnetic atoms adsorbed on metal surface in scanning tunneling spectroscopy" IVC-17/ICSS-13 and ICN+T 2007 Congress Stockholm, Sweden, 2-6 July 2007 Melanie David, Tanglaw Roman, Rifki Muhida, Hiroshi Nakanishi, Wilson Agerico Diño， Hideaki Kasai, Fumiyoshi Takano, Hisashi Shima, Hiroyuki Akinaga "First principles calculations-based model for the reactive ion etching of metal oxide surfaces" ISSP 2007- The 9th International Symposium on Sputtering and Plasma Processes Kanazawa Kokusai Hotel, Kanazawa, Japan, 6-9 June 2007 Tanglaw Roman, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Halogen-assisted copper atom abstraction dynamics" ISSP 2007- The 9th International Symposium on Sputtering and Plasma Processes, Kanazawa Kokusai Hotel, Kanazawa, Japan, 6-9 June 2007 Mary Clare Sison Escaño, Tomoya Kishi, Shinichi Kunikata, Hiroshi Nakanishi, Hideaki Kasai "Dissociative Adsorption of O2 on Pt/Fe" ICNDR 2007/International Conference on Nanospintronic Design and Realization 2007 Dresden, Germany, 21-25 May 2007【招待】to TOP 2006
Emi Minamitani, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "The Influence of Magnetic State on the Conductivity of Transition Metal Oxides Nanostructure" International Conference on Quantum Simulation and Design (QSD2006) Hiroshima, Japan, 3-6 December 2006 Rifki Muhida, Md. Mahmudur Rahman, Wilson A. Diño, Riza Muhida, Hiroshi Nakanishi, Hideaki Kasai "Quantum dynamics of halogen-based copper etching" International Conference on Quantum Simulation and Design (QSD2006) Hiroshima, Japan, 3-6 December 2006 Tanglaw Roman, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Quantum dynamics of halogen-based copper etching" International Conference on Quantum Simulation and Design (QSD2006) Hiroshima, Japan, 3-6 December 2006 Akiko Horiguchi, Reiko Tanaka, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "Computational NanoMaterials Design - From Basics to Actual Applications" International Conference on Quantum Simulation and Design (QSD2006) Hiroshima, Japan, 3-6 December 2006 Eben Sy Dy, Yoshiyuki Kubota, Hiroshi Nakanishi, Wilson Agerico Diño, Hideaki Kasai "A first principles investigation on the interaction of oxomolybdenum porphyrin with O2" International Conference on Quantum Simulation and Design (QSD2006) Hiroshima, Japan, 3-6 December 2006 Nobuki Ozawa, Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Behavior of a hydrogen atom on the Pd(111) surface and in the subsurface" International Conference on Quantum Simulation and Design (QSD2006) Hiroshima, Japan, 3-6 December 2006 Nobuki Ozawa, Tanglaw Abat Roman, Hiroshi Nakanishi, Hideaki Kasai "Hydrogen atom absorption and diffusion on the Pd(111) surface and in the subsurface within the framework of quantum method" The 10th ISSP International Symposium on Nanoscience at Surfaces (ISSP-10) Institute for Solid State Physics, Chiba, 10-13 October 2006 Melanie David, Tanglaw Roman, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai, Naoki Ando, Masanori Naritomi "A nanoscale understanding of theadhesion of polybutylene terephthalate on aluminum" The 10th ISSP International Symposium on Nanoscience at Surfaces (ISSP-10) Institute for Solid State Physics, Chiba, 10-13 October 2006 Tanglaw Roman, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai, Tsuyoshi Sugimoto, Kyouichi Tange "Forming groups of hydrogen on graphene" The 10th ISSP International Symposium on Nanoscience at Surfaces (ISSP-10) Institute for Solid State Physics, Chiba, 10-13 October 2006 Nelson Arboleda Jr., Hideaki Kasai, Wilson Agerico Diño, Hiroshi Nakanishi "First-principles studies on the dissociative adsorption of H2 on a CO-precovered Pt(111) surface" The 10th ISSP International Symposium on Nanoscience at Surfaces (ISSP-10) Institute for Solid State Physics, Chiba, 10-13 October 2006 Melanie David, Tomoya Kishi, Masanori Kisaku, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Magnetic and electronic properties of Fe-filled single-walled carbon nanotubes on metal surfaces" The 24th European Conference On Surface Science(ECOSS24) Paris, France, 4-8 September 2006 Emi Minamitani, Hiroshi Nakanishi, Hideaki Kasai "The transport properties of transition metal oxide" The 24th European Conference On Surface Science(ECOSS24) Paris, France, 4-8 September 2006 Keita Miyamoto, Hiroshi Nakanishi, Hideaki Kasai "Molecular adsorption effect on the electronic properties of tape-porphyrins" The 24th European Conference On Surface Science(ECOSS24) Paris, France, 4-8 September 2006 Tomoya Kishi, Melanie David, Hiroshi Nakanishi, Hideaki Kasai "Magnetic and electronic properties of SWNT with the Fe and Co nanowires adsorbing on its outer wall" The 24th European Conference On Surface Science(ECOSS24) Paris, France, 4-8 September 2006 Nobuki Ozawa, Tanglaw Abat Roman, Hiroshi Nakanishi, Hideaki Kasai "Quantum states of hydrogen on the Pd(111) surface and in the subsurface" The 24th European Conference On Surface Science(ECOSS24) Paris, France, 4-8 September 2006 Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai "Hydrogen atom quantum migration and scattering on platinum" The 24th European Conference On Surface Science(ECOSS24) Paris, France, 4-8 September 2006 Melanie David, Tomoya Kishi, Masanori Kisaku, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "First principles investigation on Fe-filled single-walled carbon nanotubes on Ni (111) and Cu (111)" The 17th International Conference on Magnetism (ICM) Kyoto, Japan, 20-25 August 2006 Tomoya Kishi, Melanie David, Wilson Diño, Hiroshi Nakanishi, Hideaki Kasai, Fumio Komori asai. Moriyama，F. Takano, H. Akinaga "Ab initio study for transition metal nanoislands on Cu(111)" The 17th International Conference on Magnetism (ICM) Kyoto, Japan, 20-25 August 2006 Rifki Muhida, Melanie David, Shigeno Matsumoto, Wilson Agerico Diño, Hiroyuki Akinaga, Hideaki Kasai, Hiroshi Nakanishi, "Cluster model of reactive ion etching (RIE) of interaction between FeNi4 cluster and CO ions" 6th International Conference on Reactive Plasma and 23rd Symposium on Plasma Processing (ICRP-6/SPP-23) Hotel Taikanso, Matsushima, Sendai, Japan,24-27 January 2006to TOP 2015
Nobuki Ozawa, Hiroshi Nakanishi, Hideaki Kasai Quantum states of hydrogen (H, D, T) atoms on Cu(100) and Cu(110) surfaces European Conference on Surface Science(ECOSS23) Berlin, Germany, 4-9 September 2005 Tomoya Kishi, Hideaki Kasai, Hiroshi Nakanishi, Wilson Agerico Diño, Fumio Komori Magnetic and transport properties of Fe nanostructures (thin fi lms, nanowires and nanoislands) on Cu(111) European Conference on Surface Science(ECOSS23) Berlin, Germany, 4-9 September 2005 Daisuke Matsunaka, Tomoya Kishi, Hideaki Kasai, Wilson Agerico Diño, Hiroshi Nakanishi Electronic and magnetic properties of the transition metal adatom on the group-IV semiconductor surface European Conference on Surface Science(ECOSS23) Berlin, Germany, 4-9 September 2005 Muneyuki Tsuda, Wilson Agerico Diño, Hideaki Kasai, Hiroshi Nakanishi, Hiroshi Aikawa "3d transition metal interaction with magnesium hydride MgH2" International Symposium on the Manipulation of Advanced Smart Materials (ISMASM2005) Nara, Japan, 26-27 May 2005 Melanie David, Tanglaw Roman, Hiroshi Nakanishi, Hideaki Kasai, Naoki Ando, Masanori Naritomi "A density functional-based investigation of adhesion of poly(butylene terephthalate) on aluminum" International Symposium on the Manipulation of Advanced Smart Materials (ISMASM2005 Nara, Japan, 26-27 May 2005 Rifki Muhida, Henry Setiyanto, Md. Mahmudur Rahman, Tomoya Kishi, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Effect of inhomogeneity of spin density on ortho-para H2 conversion yield on M(C6H6)2 (M=Mn, Fe, Co) clusters" International Symposium on the Manipulation of Advanced Smart Materials (ISMASM2005) Nara, Japan, 26-27 May 2005 Nelson B. Arboleda Jr., Hideaki Kasai, Wilson Agerico Diño, Hiroshi Nakanishi "Quantum Dynamics Study on the Interaction of H2 on a Pt(111) Surface" International Symposium on the Manipulation of Advanced Smart Materials (ISMASM2005) Nara, Japan, 26-27 May 2005 Rifki Muhida, Melanie David, Md. Mahmudur Rahman, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Spin polarization in multiple-decked sandwich clusters: Vn(C6H6)n+1 (n=1,2)" International Symposium on Surface Science and Nanotechnology (ISSS-4) Omiya Sonic City, Saitama, Japan, 14-17 November 2005 Rifki Muhida, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Overcoming hydrogen storage: Increasing o-p H2 conversion yield" Asian Physics Symposium 2005 (APS 2005) Grand Aquila Hotel, Bandung, 7-8 December 2005to TOP 2004
Tomoya Kishi, Hideaki Kasai, Hiroshi Nakanishi, Wilson Agerico Diño, Fumio Komori TRANSPORT PROPERTIES of Fe THIN FILMS ON Cu SURFACES AND APPLICATION FOR NANOSPINTRONICS DEVICE International Conference on Nanospintronics Design and Realization (ICNDR 2004) Kyoto, JAPAN, 24-28 May 2004 Masanori Kisaku, Tomoya Kishi, Daisuke Matsunaka, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai AB INITIO STUDY OF MAGNETIC PROPERTIES OF Fe-FILLED CARBON NANOTUBE International Conference on Nanospintronics Design and Realization (ICNDR 2004) Kyoto, JAPAN, 24-28 May 2004 Kenji Suzuki, Tomoya Kishi, Daisuke Matsunaka, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai STABLE STRUCTURES AND MAGNETIC PROPERTIES OF Fe NANOWIRES ON Si(001) International Conference on Nanospintronics Design and Realization (ICNDR 2004) Kyoto, JAPAN, 24-28 May 2004 Rifki Muhida, Wilson Agerico Diño, Hideaki Kasai, Hiroshi Nakanishi "Spin polarization of multiple-decked sandwich clusters: Mn(C6H6)n+1 (M= Sc, Ti, V, Cr, Mn, Fe, Co, Ni)" International Conference on Nanospintronics Design and Realization (ICNDR 2004) Kyoto, JAPAN, 24-28 May 2004 Muneyuki Tsuda, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Spin Polarization Effects on Cyclohexane Dehydrogenation with a Ni Atom" International Conference on Nanospintronics Design and Realization (ICNDR 2004) Kyoto, JAPAN, 24-28 May 2004 Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai Hydrogen Interaction with Various Surfaces of Graphite International Vaccume Congress 16(IVC-16), 12the Internatinal Conference on Solid Surfaces(ICSS-12), 8th International Nanometer-Scale Science and Technology(NANO-8), 17th Vacuum National Symposium(AIV-17) Venice, Italy, 29 Jun-2 July 2004 Daisuke Matsunaka, Md. Mahmudur Rahman, Hideaki Kasai, Wilson Agerico Diño, Hiroshi Nakanishi Coherent Potential Approximation in Disordered Systems with Magnetic Impurities International Vaccume Congress 16(IVC-16), 12the Internatinal Conference on Solid Surfaces(ICSS-12), 8th International Nanometer-Scale Science and Technology(NANO-8), 17th Vacuum National Symposium(AIV-17) Venice, Italy, 29 Jun-2 July 2004 Rifki Muhida, Wilson Agerico Diño, Hideaki Kasai, Hiroshi Nakanishi Spin polarization of an multiple-decked sandwich clusters M(C6H6)2 (M = Sc, Ti, V, Cr, Mn, Fe, Co, Ni ) International Vaccume Congress 16(IVC-16), 12the Internatinal Conference on Solid Surfaces(ICSS-12), 8th International Nanometer-Scale Science and Technology(NANO-8), 17th Vacuum National Symposium(AIV-17) Venice, Italy, 29 Jun-2 July 2004 Tomoya Kishi, Hideaki Kasai, Hiroshi Nakanishi, Wilson Agerico Diño, Fumio Komori Thickness dependences of magnetic properties of Fe thin films on Cu(111) International Vaccume Congress 16(IVC-16), 12the Internatinal Conference on Solid Surfaces(ICSS-12), 8th International Nanometer-Scale Science and Technology(NANO-8), 17th Vacuum National Symposium(AIV-17) Venice, Italy, 29 Jun-2 July 2004 Muneyuki Tsuda, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Theoretical Study of Cyclohexane Dehydrogenation on Pt(111) and Ni(111)" International Vaccume Congress 16(IVC-16), 12the Internatinal Conference on Solid Surfaces(ICSS-12), 8th International Nanometer-Scale Science and Technology(NANO-8), 17th Vacuum National Symposium(AIV-17) Venice, Italy, 29 Jun-2 July 2004 Muneyuki Tsuda, Wilson Agerico Diño, Hiroshi Nakanishi, Hideaki Kasai "Orientation Dependence of O2 Dissociation from Heme-O2 Adduct" International Symposium on Stereodynamics of Chemical Reactions 2004 Osaka, JAPAN, 28 November-3 December 2004 Nelson B. Arboleda Jr., Hideaki Kasai, Wilson Agerico Diño, Hiroshi Nakanishi "Orientational Effects on the Dissociative Adsorption of H2 on Li(100) Surface" International Symposium on Stereodynamics of Chemical Reactions 2004 Osaka, JAPAN, 28 November-3 December 2004 Rifki Muhida, Wilson Agerico Diño, Hideaki Kasai, Hiroshi Nakanishi "Spin polarization of multiple-decked sandwich clusters: M(C6H6)2" International Symposium on the Creation of Novel Nanomaterials (ISCNN2004), Osaka University, Osaka, Japan, 20-22 January 2004to TOP 2003
Tomoya Kishi, Hiroshi Nakanishi, Hideaki Kasai, Wilson Agerico Diño, Fumio Komori "SPIN-DEPENDENT TRANSPORT THROUGH Fe NANOWIRES ON Cu SURFACES" International Conference on Magnetism (ICM 2003) Rome, ITALY, 27 July-1 August 2003 Hiroshi Nakanishi, Tomoya Kishi, Hideaki Kasai, Fumio Komori, Ayao Okiji "MAGNETIC AND TRANSPORT PROPERTIES OF NANOSTRUCTURES CONSTRUCTED BETWEEN STM TIP AND SURFACES" International Conference on Magnetism (ICM 2003) Rome, ITALY, 27 July-1 August 2003 Wilson Agerico Diño, Rifki Muhida, Nelson Buntimil Arboleda Jr., Hiroshi Nakanishi, Hideaki Kasai "Inducing Spin Polarization in Carbon Materials by Magnetic Adsorbates" International Conference on Magnetism (ICM 2003) Rome, ITALY, 27 July-1 August 2003 Tomoya Kishi, Hideaki Kasai, Hiroshi Nakanishi, Wilson Agerico Diño, Fumio Komori Magnetic nanowires on Cu surfaces European Conference on Surface Science (ECOSS 22) Praha, Czech, 7-12 September 2003to TOP 2002
Tomoya Kishi, Hiroshi Nakanishi, Hideaki Kasai, Fumio Komori, Ayao Okiji Stable Structures of Fe nanowires on Cu(111) Asia-Pacific Surface & Interface Analysis Conference (APSIAC 02) Tokyo, JAPAN, 1-4 October 2002 Rifki Muhida, Yoshio Miura, Wilson Agerico Diño, Hideaki Kasai, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani, Tatsuo Okano "Effect of molecular orientation on ortho-para H2 conversion on a metal surface" Asia-Pacific Surface & Interface Analysis Conference (APSIAC 02) Tokyo, JAPAN, 1-4 October 2002 Hiroshi Nakanishi, Hideaki Kasai, Tomoya Kishi, Fumio Komori, Ayao Okiji Transport properties of magnetic atom bridges controlled by a scanning tunneling microscope 11th International Conference on Solid Films and Surfaces (ICSFS-11) Marseille, FRANCE, 8-12 July 2002 Rifki Muhida, Wilson Agerico Diño, Yoshio Miura, Hideaki Kasai, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani, Tatsuo Okano "High rate of o-p H2 conversion induced by dynamical quantum filtering effect and steric effect" 17th International Colloquium on Magnetic Films and Surfaces (ICMFS 2002) Kyoto Research Park (KRP), Kyoto, Japan, 5-8 March 2002 Rifki Muhida, Wilson Agerico Diño, Yoshio Miura, Hideaki Kasai, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani, Tatsuo Okano "High rate of o-p H2 conversion induced by dynamical quantum filtering effect and steric effect" 17th International Colloquium on Magnetic Films and Surfaces (ICMFS 2002) Kyoto Research Park (KRP), Kyoto, Japan, 5-8 March 2002 Hiroshi Nakanishi, Hideaki Kasai, Tomoya Kishi, Fumio Komori, Ayao Okiji Transport and Magnetic Properties of Magnetic Alloy Atom Bridges The 23rd International Conference on Low Temperature Physics (LT 23) Hiroshima, JAPAN, 20 – 27 August 2002 Rifki Muhida, Hideaki Kasai, Wilson Agerico Diño, Yoshio Miura, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani, Tatsuo Okano "Reaction design of ortho-para conversion of H2 using dynamical quantum filtering effect and steric effect" European Conference on Surface Science (ECOSS21), 7th International Conference on Nanometer-Scale Science and Technology 21st, 24-28 June 2002, Malmo, Swedento TOP 2001
Hideaki Kasai, Hiroshi Nakanishi, Tomoya Kishi, Fumio Komori, Ayao Okiji Magnetic properties of Fe-Ni alloy atom bridges Yamada Conference LVII on Atomic-scale surface designing for functional low dimensional materials Tsukuba, JAPAN, 14-16 November 2001 Hiroshi Nakanishi, Hideaki Kasai, Tomoya Kishi, Fumio Komori, Ayao Okiji STM-tip induced magnetic state change of Fe-atom bridge Yamada Conference LVII on Atomic-scale surface designing for functional low dimensional materials Tsukuba, JAPAN, 14-16 November 2001 Rifki Muhida, Wilson Agerico Diño, Yoshio Miura, Hideaki Kasai, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani, Tatsuo Okano "Dynamics of ortho-para H2 conversion on a metal oxide surface: Cartwheel-like rotations versus helicopter-like rotations" Yamada Conference LVII on Atomic-scale surface designing for functional low dimensional materials Tsukuba, JAPAN, 14-16 November 2001 Hideaki Kasai, Hiroshi Nakanishi, Tomoya Kishi, Fumio Komori, Ayao Okiji “Magnetic and transport properties of compressed Fe atom bridge” 4th International COE Symposium on Atomic Scale Processing and Novel Properties in Nanoscopic Materials Osaka, JAPAN, 13-14 December 2001 Hiroshi Nakanishi, Hideaki Kasai, Ayao Okiji “Magnetic properties and structure stability of ladder atom bridge made of iron” INTERNATIONAL WORKSHOP ON "Dynamical Phenomena Related with Electrons at Surfaces" (Dyna-PRESS) 27th IUVSTA Workshop January, 2001, Kushiro, Japan 【招待】to TOP 2000
Rifki Muhida, Wilson Agerico Diño, Atsushi Fukui, Hideaki Kasai, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani, Tatsuo Okano "Molecular orientation dependence of o-p conversion of H2 interacting with solid surfaces" 3rd International Symposium on Atomic Scale Processing and Novel Properties in Nanoscopic Materials, 13-14 December 2000, Icho-Kaikan, Osaka University, Osaka, Japan. Rifki Muhida, Wilson Agerico Diño, Atsushi Fukui, Hideaki Kasai, Hiroshi Nakanishi, Ayao Okiji, Katsuyuki Fukutani,Tatsuo Okano "Ortho-para conversion of H2 interacting with solid surfaces - The effect of molecular orientation -" International Symposium on Surface and Interface (ISSI 2000) Property of Different Symmetry Crossing 2000 17-20 October 2000, Aichi-ken Sangyo Boeki-kan, Nagoya, Japan. Hiroshi Nakanishi, Yuji Morigaki, Hideaki Kasai, Ayao Okiji “Quantum transport properties in atom-sized bridges of magnetic” The Third SANKEN International Symposium on Advanced Nanoelectronics: Devices, Materials, and Computing, "Advanced Nanoelectronics: Devices, Materials, and Computing" March, 2000, Osaka, Japan【招待】to TOP 1999
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Ayao Okiji, Hideaki Kasai, Hiroshi Nakanishi “The effects of electron excitations on the behaviour of particles scattered by metal surfaces” 18th Taniguchi Symposium Kashikojima, Japan, January 22-27, 1996to TOP