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PHASEを用いた学術論文

PHASEを用いた学術論文リスト

ここでは、PHASE を用いた学術論文をご紹介します。研究開発の参考資料としてご利用ください。弊社では PHASE を用いた文献全てを把握しておりませんので、リストに載っていない論文がございましたら、お手数おかけして申し訳ありませんが E-mail: office@advancesoft.jp までご連絡いただきたくお願いいたします。

  1. Motoharu Imai and Yoshitaka Matsushita, "Effect of Ca substitution on crystal structure and band gap of solar cell material BaSi2", Journal of Solid State Chemistry 331, 124549 (2024). [Abstract]
  2. Mutsumi Miuchi, Eiji Sawai, Shunsuke Yahagi, and You Yin, "Doping O into Conventional GeTe/Sb2Te3 Superlattice for Functional Material of Artificial Synapse", Proceedings of the 7th International Conference on Technology and Social Science, IPS02-04 (2023) (invited paper). [Abstract]
  3. Hiroyuki Usui, Yasuhiro Domi, Yuya Yamamoto, Takeo Hoshi, Toshiyuki Tanaka, Naoto Oishi, Noriko Nitta, and Hiroki Sakaguchi, "Nickel-Doped Titanium Oxide with Layered Rock-Salt Structure for Advanced Li-Storage Materials", ACS Appl. Electron. Mater. 5, 6292-6304 (2023). [Abstract]
  4. Takahiro Kaneko and Kyosuke Yoshimi, "Variations in the elastic properties and lattice parameters of Mo-Ti and Mo-Cr BCC solid solutions, as estimated by DFT calculations", Computational Materials Science 220, 112026 (2023). [Abstract]
  5. Serina Tanaka and Hiroki Adachi, "Soft X-ray XAFS Analysis of Cluster Formation Process during 353 K Aging in Al-Mg-Si Alloys", MATERIALS TRANSACTIONS 64, 458-466 (2023). [Abstract]
  6. Kazuhiko Fukamachi, "Detailed relationship between the microstructure and properties of age-hardened Cu-4 at% Ti alloy", Materials Today Communications 34, 105202 (2023). [Abstract]
  7. 田中 芹奈, 足立 大樹, "XAFS 測定を用いた Al-Mg-Si 合金における二段時効の負の効果に及ぼす Sn の影響の解明", 軽金属 72巻10号 p. 593-599 (2022). [Abstract]
  8. 今井 基晴, "特徴的な Si 原子配列を持つシリサイドの電子状態および光学的性質", レーザー学会誌「レーザー研究」50巻10号「14 族元素をベースとした光機能半導体の最新研究」特集号（2022年10月）580. 会誌： https://www.lsj.or.jp/publications/rle/
  9. Takahiro Yamada, Daigorou Hirai, Toshiya Ikenobe, Hisanori Yamane and Zenji Hiroi, "Crystal structure and superconductivity of NaAlSi1-xGex single crystals", J. Phys.: Conf. Ser. 2323, 012004 (2022) [Abstract]
  10. Haena Yim, So Yeon Yoo, Haneul Choi, Hye Jung Chang, Seong-Ju Hwang, Sahn Nahm, Minoru Osada, Ji-Won Choi, "Advances in dielectric performance of atomically engineered Sr1.8Bi0.2Nb3O10 perovskite nanosheet thin films", Journal of Alloys and Compounds 925, 166606 (2022). [Abstract]
  11. Yasuhiro Domi, Hiroyuki Usui, Takumi Ando and Hiroki Sakaguchi, "Impact of the crystalline phase of binary silicide on its lithiation and delithiation properties", Mater. Adv. 3, 6231 (2022). [Abstract]
  12. Hiroyuki Usui, Yasuhiro Domi, Shin-ichiro Izaki, Akira Nasu, Atsushi Sakuda, Akitoshi Hayashi, and Hiroki Sakaguchi, "Room-Temperature Preparation of All-Solid-State Lithium Batteries Using TiO2 Anodes and Oxide Electrolytes", J. Phys. Chem. C 126, 10320 (2022). [Abstract]
  13. Shigeto Yamasaki, Tatsuya Morikawa, Masaki Tanaka, Yasuaki Watanabe, Mitsuo Yamashita, and Sakae Izumi, "Evaluation of Cleavage Fracture Behavior of C14 Fe2W Laves Phase by First-principles Calculations and Crystal Orientation Analysis", ISIJ International, June 01, 2022 (Advance online publication, open access). [Abstract]
  14. Takashi Hasegawa and Yuki Seki, "TEM-based crystal structure analysis of body-centered tetragonal structure in non-epitaxial FeCo film with added V and N", Materials Letters 313, 131734 (2022). [Abstract]
  15. Motoharu Imai, Takahiro Yamada and Hisanori Yamane, "Electronic structure and optical properties of NaSi", Jpn. J. Appl. Phys. 61, 031004 (2022). [Abstract]
  16. Takashi Hasegawa, "Challenges toward development of rear-earth free FeCo based permanent magnet", ELectronics and Communications in Japan 104, e12307 (2021). [Abstract]
  17. 山﨑 重人, 田中 將己, 森川 龍哉, 渡部 康明, 山下 満男, 和泉 栄, "第一原理計算と結晶方位解析を用いたC14 Fe2W Laves相の劈開破壊挙動の評価", 鉄と鋼 107 巻 11 号 p. 977-985 (2021). [Abstract]
  18. Serina Tanaka, Hiroki Adachi, Takehiro Nonomura, "Soft X-ray XAFS Analysis of Cluster Formation Behavior during Natural Aging on an Al-Mg-Si Alloy", Materials Transactions 62, 1448 (2021). [Abstract]
  19. Sota Inoue, Hisanori Yamane, and Takahiro Yamada, "Identification and characterisation of a new orthorhombic Ti6Sn5O0.9 structure", Materials Today Communications 28, 102704 (2021). [Abstract]
  20. Yuki Asamiya, Takahiro Yamada, and Hisanori Yamane, "Synthesis and Characterization of NaCd0.92Sn1.08, Na(Cd0.28Sn0.72)2 and Na2CdSn5 with Three-Dimensional Cd-Sn Frameworks", Inorganics 9, 19 (2021). [Abstract]
  21. 田中芹奈、足立大樹、野々村壮紘、 "軟X線XAFS測定を用いたAl-Mg-Si合金における自然時効によるクラスタ形成過程の解明"、 軽金属 71巻3号 144-151 (2021). [Abstract]
  22. Takahiro Yamada, Daigorou Hirai, Hisanori Yamane, Zenji Hiroi, "Superconductivity in the Topological Nodal-line Semimetal NaAlSi", Journal of the Physical Society of Japan 90, 034710 (2021). [Abstract]
  23. Yuki Kamikawa, Koji Amezawa, and Kenjiro Terada, "Energy-Loss Near-Edge Structures and Low-Loss Structures of Polymers in a Solid Electrolyte Interface Formed from Fluoroethylene Carbonate on a Si Anode Clarified by DFT Calculations", The Journal of Physical Chemistry C 125, 3890 (2021). [Abstract]
  24. 長谷川崇, "希土類フリーである正方晶 FeCo 基合金磁石の開発に向けた進展", 電気学会論文誌 A (基礎・材料・共通部門誌) 141 巻 2 号 p. 105-111 (2021). [Abstract]
  25. Takashi Hasegawa, Le Duy Long, and Yasuko Nakamura, "MFM Observation of High Coercivity in Nanostructured Tetragonally Distorted FeCo Films", IEEE Transactions on Magnetics 57, 6500105 (2021). [Abstract]
  26. Rahul Agrawal and Kiyoteru Kobayashi, "First-Principles Study of Defect Levels Caused by Transition Metal Atoms in Silicon Nitride for Non-Volatile Memory Applications", ECS Transactions 98, 65 (2020). [Abstract]
  27. 束村基行, 山室賢輝, 関戸信彰, 連川貞弘, 吉見享祐, "Ti と Al を共添加した MoSiBTiC 合金のミクロ組織と相安定性", 日本金属学会誌 84, 217 (2020). [Abstract]
  28. P. Uredat, M. T. Elm, R. Horiguchi, P. J. Klar, S. Hara, "The transport properties of InAs nanowires: an introduction to MnAs/InAs heterojunction nanowires for spintronics", J. Phys. D: Appl. Phys. 53, 333002 (2020). [Abstract]
  29. Masato Kato, Mitsutoshi Nishiwaki, and Hiroyuki Fujiwara, "Very high oscillator strength in the band-edge light absorption of zincblende, chalcopyrite, kesterite, and hybrid perovskite solar cell materials", Phys. Rev. Materials 4, 035402 (2020). [Abstract]
  30. B. Zhang, M. Seki, H. Zhou, J. Chen, and H. Tabata, "InFeO3 photoelectrode with two-dimensional superlattice for visible- and ultraviolet-light-driven water splitting", APL Materials 8, 051107 (2020). [Abstract]
  31. Satoshi Okuda, Masaaki Shimatani, Shoichiro Fukushima, Shinpei Ogawa, Takashi Ikuta, and Kenzo Maehashi "First-principles calculation of electronic structure of turbostratic graphene for high-responsivity infrared detection with enhanced photogating effect", Proc. SPIE 11407, Infrared Technology and Applications XLVI, 114071J (23 April 2020). [Abstract]
  32. 武政 友佑, 白井 千尋, 長谷川 崇, Fe-Co-N薄膜へのAl添加による磁気異方性の増大, 日本磁気学会論文特集号 4巻1号 p.9-13 (2020). [Abstract]
  33. Yukinori Nishigaki, Takayuki Nagai, Mitsutoshi Nishiwaki, Takuma Aizawa, Masayuki Kozawa, Kota Hanzawa, Yoshitsune Kato, Hitoshi Sai, Hidenori Hiramatsu, Hideo Hosono, and Hiroyuki Fujiwara, "Extraordinary Strong Band‐Edge Absorption in Distorted Chalcogenide Perovskites", Solar RRL, first published 21 January 2020. [Abstract]
  34. Mitsutoshi Nishiwaki, Hiroyuki Fujiwara, "Highly accurate prediction of material optical properties based on density functional theory", Computational Materials Science 172, 109315 (2020). [Abstract]
  35. Katsutoshi Hyodo, Shinji Munetoh, Toshihiro Tsuchiyama, Setsuo Takaki, "Empirical interatomic potential for Fe-N binary system based on Finnis-Sinclair potential", Computational Materials Science 174, 109500 (2020). [Abstract]
  36. Fumitaka Yoshimura, Hisanori Yamane, and Takahiro Yamada, "Synthesis, Crystal Structure, and Luminescence Properties of a White-Light-Emitting Nitride Phosphor, Ca0.99Eu0.01AlSi4N7", Inorganic Chemistry, online December 6, 2019. [Abstract]
  37. Takahiro Yamada, Kohei Aiba, Daigorou Hirai, Zenji Hiroi and Hisanori Yamane, "Structure analysis and electrical resistivity of the high- and low-temperature phases of NaPd3Ge2 single crystal", Japanese Journal of Applied Physics, online 26 December 2019. [Abstract]
  38. Takahiro Yamada, Daigorou Hirai, Zenji Hiroi, and Hisanori Yamane, "Na3Pt10Si5: A Non-Centrosymmetric Superconductor Having Rattling Na Atoms in the Tunnel Framework Structure", Inorganic Chemistry 58, 12911-12917 (2019). [Abstract]
  39. Muhammad Rizwan, Samina Gul, Tahir Iqbal, Uzma Mushtaq, M Hassan Farooq, Muhammad Farman, Rabia Bibi and Mohsin Ijaz, "A review on perovskite lanthanum aluminate (LaAlO3), its properties and applications", Materials Research Express 6, 112001 (2019). [Abstract]
  40. Ameya Sathe, Munetoshi Seki, Hang Zhou, Jia Xin Chen and Hitoshi Tabata, "Bandgap engineering in V-substituted α-Fe2O3 photoelectrodes", Appl. Phys. Express 12, 091003 (2019). [Abstract]
  41. Motoharu Imai, Mukesh Kumar, Naoto Umezawa, "Electronic states of Zintl-phase solar-cell material BaSi2", Scripta Materialia 172, 43-46 (2019). [Abstract]
  42. Motoharu Imai, Akira Sato, and Yoshitaka Matsushita, "Effect of temperature on the crystal structure of BaSi2", Physica B: Condensed Matter, available online 14 June, 2019. [Abstract]
  43. Mitsutoshi Nishiwaki, Keisuke Nagaya, Masato Kato, Shohei Fujimoto, Hitoshi Tampo, Tetsuhiko Miyadera, Masayuki Chikamatsu, Hajime Shibata, and Hiroyuki Fujiwara, "Tail state formation in solar cell materials: First principles analyses of zincblende, chalcopyrite, kesterite, and hybrid perovskite crystals", Phys. Rev. Materials 2, 085404 (2018). [Abstract]
  44. Keisuke Nagaya, Shohei Fujimoto, Hitoshi Tampo, Shinho Kim, Mitsutoshi Nishiwaki, Yukinori Nishigaki, Masato Kato, Hajime Shibata, and Hiroyuki Fujiwara, "Very small tail state formation in Cu2ZnGeSe4", Appl. Phys. Lett. 113, 093901 (2018). [Abstract]
  45. Kohei Tada, Yasushi Maeda, Hiroyuki Ozaki, Shingo Tanaka and Shin-ichi Yamazaki, "Theoretical investigation on the interaction between Rh III octaethylporphyrin and a graphite basal surface: a comparison study of DFT, DFT-D, and AFM", Phys. Chem. Chem. Phys. 20, 20235-20246 (2018). [Abstract]
  46. Akihide Hayashi, Yoshinori Ato, Kohei Tada, Hiroaki Koga, Takashi Kawakami, Shusuke Yamanaka, Mitsutaka Okumura, "Theoretical Investigation of Surface Oxidation of NiO/Au Core-Shell Catalyst", e-Journal of Surface Science and Nanotechnology 16, 242-246 (2018). [Abstract]
  47. K. Tada, H. Koga, M. Okumura, S. Tanaka, "Estimation of spin contamination error in dissociative adsorption of Au2 onto MgO(001) surface: First application of approximate spin projection (AP) method to plane wave basis" Chem. Phys. Lett. 701, 103 (2018) [Abstract]
  48. Y. Takagiwa, Y. Isoda, M. Goto, Y. Shinohara, "Conduction type control and power factor enhancement of the thermoelectric material Al2Fe3Si3", J. Phys. Chem. Solids 118, 95 (2018). [Abstract]
  49. Y. Takagiwa, Y. Isoda, M. Goto, Y. Shinohara, "Electronic structure and thermoelectric properties of narrow-band-gap intermetallic compound Al2Fe3Si3" , J. Therm. Anal. Calorim. 131, 281 (2018) [Abstract]
  50. Hiroyuki Fujiwara, Masato Kato, Masato Tamakoshi, Tetsuhiko Miyadera, and Masayuki Chikamatsu, “Optical characteristics and operational principles of hybrid perovskite solar cells”, Phys. Status Solidi A 1700730 (2018). [Abstract]
  51. K. Takahashi, M. Sakamoto, K. Kumagai, T. Hasegawa, S. Ishio, "Uniaxial magnetic anisotropy of tetragonal FeCoV and FeCoVC films" ; J. Phys. D: Appl. Phys. 51 (2018) 065005. [Abstract]
  52. Kohei Tada, Hiroaki Koga, Mitsutaka Okumura, Shingo Tanaka, "Clarification of the interaction between Au atoms and the anatase TiO2(1 1 2) surface using density functional theory" Surface Science 670 (2018) 23-32. [Abstract]
  53. Bao-Wen Li, Minoru Osada, Yoon-Hyun Kim, Yasuo Ebina, Kosho Akatsuka, and Takayoshi Sasaki, "Atomic Layer Engineering of High-κ Ferroelectricity in 2D Perovskite", J. Am. Chem. Soc. 139 (31), pp 10868-10874 (2017) [Abstract]
  54. Masato Kato, Takemasa Fujiseki, Tetsuhiko Miyadera, Takeshi Sugita, Shohei Fujimoto, Masato Tamakoshi, Masayuki Chikamatsu and Hiroyuki Fujiwara, “Universal rules for visible-light absorption in hybrid perovskite materials”, J. Appl. Phys. 121, 115501 (2017) [Selected as a featured paper]. [Abstract]
  55. Hiroyuki Fujiwara, Shohei Fujimoto, Masato Tamakoshi, Masato Kato, Hideyuki Kadowaki, Tetsuhiko Miyadera, Hitoshi Tampo, Masayuki Chikamatsu, and Hajime Shibata, “Determination and interpretation of the optical constants for solar cell materials”, Appl. Surf. Sci. 421276 (2017). [Abstract]
  56. 髙宮 俊人, 石原 健, 宗藤 伸治, 山田 和広, 荒牧 正俊, 古君 修 "3％Si鋼中に析出したMnSeおよびMnSの地鉄との方位関係", 熱処理56巻1号p.16-21(2016). [Abstract]
  57. Masaki Shirayama, Masato Kato, Tetsuhiko Miyadera, Takeshi Sugita, Takemasa Fujiseki, Shota Hara, Hideyuki Kadowaki, Daisuke Murata, Masayuki Chikamatsu, and Hiroyuki Fujiwara, “Degradation mechanism of CH3NH3PbI3 perovskite materials upon exposure to humid air”, J. Appl. Phys. 119, 115501 (2016). [Abstract]
  58. Masaki Shirayama, Hideyuki Kadowaki, Tetsuhiko Miyadera, Takeshi Sugita, Masato Tamakoshi, Masato Kato, Takemasa Fujiseki, Daisuke Murata, Shota Hara, Takurou N. Murakami, Shohei Fujimoto, Masayuki Chikamatsu, and Hiroyuki Fujiwara, “Optical transitions in hybrid perovskite solarcells: Ellipsometry, density functional theory, and quantum efficiency analyses for CH3NH3PbI3”, Phys. Rev. Applied 5, 014012 (2016) [Abstract]
  59. Yoshiki Hirate, Hitoshi Tampo, Shota Minoura, Hideyuki Kadowaki, Akihiro Nakane, Kang Min Kim, Hajime Shibata, Shigeru Niki, and Hiroyuki Fujiwara, Dielectric functions of Cu2ZnSnSe4 and Cu2SnSe3 semiconductors, J. Appl. Phys. 117, 015702 (2015). [Abstract]
  60. Y. Takagiwa, S. Utada, I. Kanazawa and K. Kimura (2015) MoSi2-type narrow band gap intermetallic compound Al6Re5Si4 as a thermoelectric material , Journal of Materials Chemistry C Materials for optical, magnetic and electronic devices , DOI: 10.1039/C5TC01608H, Received 03 Jun 2015, Accepted 23 Jun 2015, First published online 07 Jul 2015 [Abstract]
  61. Y. Takagiwa, Y. Miyazaki, T. Yoshida, D. Yanagihara, S. Ueda, K. Kitahara, K. Kimura (2015) Thermoelectric properties of (α-, δ-, ζ-) Ti-Ru-B approximants for the decagonal quasicrystal , Solid State Sciences, doi:10.1016/j.solidstatesciences.2015.02.008 [Abstract]
  62. Y. Guo, S. Inoue, A. Kobayashi, J. Ohta, and H. Fujioka, "Theoretical investigation of InN growth on Mn-stabilized zirconia (111) substrates", Thin Solid Films 551, 110-113 (2014). [Abstract]
  63. Y. Takagiwa, T. Yoshida, D. Yanagihara, K. Kimura, (2014) Thermoelectric Properties of Pseudogap Ti10Ru19B8 and Ti9TM2Ru18B8 (TM:Cr-Cu) Compounds , Journal of Electronic Materials, DOI 10.1007/s11664-014-3423-8 [Abstract]
  64. Junya Nakamura, Takahiro Kaneko, Takashi Hara, Kyosuke Yoshimi, Kouichi Maruyama, Hirokazu Katsui, Takashi Goto (2014) Site-occupation behavior and solid-solution hardening effect of rhenium in Mo5 SiB2 , Intermetallics, Volume 53, October 2014, Pages 85-91, DOI 10.1016/j.intermet.2014.04.009 [Abstract]
  65. Shinji Munetoh, Makoto Saisho, Takuya Oka, Toshiko Osada, Hideshi Miura, Osamu Furukimi (2014) Reinvestigation of Thermoelectric Properties of n - and p -Type Ba8-d Au x Si46-x-y Clathrate, Journal of Electronic Materials DOI 10.1007/s11664-014-3118-1 [Abstract]
  66. Takashi Inushima, Yuichi Ota, and Hiromu Shiomi (2014) Evolution of the Impurity Band to Diamond-Like Valence Bands in Boron Doped Diamond, J. Phys. Soc. Jpn., Vol.83, No.2, Article ID: 024715 DOI: 10.7566/JPSJ.83.024715 [Abstract]
  67. Y. Guo, S. Inoue, A. Kobayashi, J. Ohta, and H. Fujioka, "Theoretical investigation of polarity determination for c-plane InN grown on yttria-stabilized zirconia (111) substrates with yttrium surface segregation", Appl. Phys. Express 6, 021002 (2013). [Abstract]
  68. Y. Guo, S. Inoue, A. Kobayashi, J. Ohta, and H. Fujioka, "Theoretical study of the initial stage of InN growth on cubic zirconia (111) substrates", Phys. Status Solidi RRL 7, 207 (2013). [Abstract]
  69. Tsunehiro Takeuchi, Yuichi Terazawa, Yukihiro Furuta, Akio Yamamoto, Masashi Mikami, "Effect of Heavy Element Substitution and Off-Stoichiometric Composition on Thermoelectric Properties of Fe2VAl-Based Heusler Phase", Journal of Electronic Materials 42, 2084-2091 (2013). [Abstract]
  70. K. Yoneta, R. Sato, Y. Iwata, K. Atsumi, K. Okamoto and Y. Sato, "Study of Low Load and Temperature, High Heat-Resistant Solid-Phase Sn-Ag Bonding with Formation of Ag3Sn Intermetallic Compound Via Nanoscale Thin Film Control for Wafer-Level 3D-Stacking for 3D LSI", IEEE 63rd Electronic Components and Technology Conference, Las Vegas, NV, pp. 2381-2384, 2013. [Abstract]
  71. Satoko Tasaki, Naoki Komori, and Soshu Kirihara, "Fabrication of Oxide Ceramics Dendrites for Porous Electrodes by Using Stereolithography", IMAPSource Proceedings 2012 (CICMT), 152-157 (2012).  [Abstract]
  72. 寺澤 佑一, 三上 祐史, 伊藤 孝至, 竹内 恒博, “Fe2VAlの電子構造と熱電物性における重元素部分置換効果”, 日本金属学会誌76巻3号 p. 216-221 (2012). [Abstract]
  73. 米田 聖人, 佐藤 了平, 岩田 剛冶, 宮川 春彦, 礒野 貴充, 岡本 和也, "第一原理計算によるSnO2系透明電極の電子状態解析と低抵抗化に関する研究", 溶接学会論文集30巻1号 p. 86-93, 2012. [Abstract]
  74. Takashi Yamamoto, Shingo Ogawa, Jun-ichi Tsuji, Koji Kita, Katsunori Tagami, Tsuyoshi Uda, Takuji Hosoi, Takayoshi Shimura, and Heiji Watanabe，“Comprehensive Study of the X-Ray Photoelectron Spectroscopy Peak Shift of La-Incorporated Hf Oxide for Gate Dielectrics”, Jpn. J. Appl. Phys. 51 (2012) 048005，2012. [Abstract]
  75. Shin KIKUCHI, Akikazu KURIHARA, Hiroyuki OHSHIMA, Kenro HASHIMOTO, "Theoretical Study of Sodium-Water Surface Reaction Mechanism", Journal of Power and Energy Systems 6, 76-86 (2012). [Abstract]
  76. Seungwon PARK,Shota ITO,Kaoru TAKASU,Takeshi YAO (2012) Multistage Li Insertion and Extraction Relaxation Analysis of γ-Fe2O3. Electrochemisty 80, 804-807. [Abstract]
  77. Shin Kikuchi, Hiroyuki Ohshima, Kenro Hashimoto, "Reaction Path Analysis of Sodium-Water Reaction Phenomena in support of Chemical Reaction Model Development", Proceedings of International Conference on Nuclear Engineering, 2011.19, ICONE19-43782 (2011). [Abstract]
  78. Chikashi Suzuki, Toshio Nakagiri, "The configuration and electronic state of SO3 adsorbed on Au surface", Journal of Physics and Chemistry of Solids 72, 10-16 (2011). [Abstract]
  79. Mineharu Tsukada, Masato Wakamura, Naoya Yoshida, Toshiya Watanabe, "Band gap and photocatalytic properties of Ti-substituted hydroxyapatite: Comparison with anatase-TiO2", Journal of Molecular Catalysis A: Chemical 338, 18-23 (2011) [Abstract]
  80. T. Matsunaga, R. Kojima, N. Yamada, T. Fujita, K. Kifune, Y. Kubota and M. Takata, "Structural investigation of GeSb6Te10 and GeBi6Te10 intermetallic compounds in the chalcogenide homologous series", Acta Cryst. B 66, 407-411 (2010). [Abstract]
  81. H. Watanabe, K. Kawabata and T. Ichikawa, "A Tight Binding Method Study of Optimized$\hbox{Si}{-} \hbox{SiO}_{2}$System," IEEE Transactions on Electron Devices 57, 3084-3091 (2010). [Abstract]
  82. M. Yoshitake, I. Karas, and J. Houfek (2010) Position of segregated Al atoms and the work function: Experimental low energy electron diffraction intensity analysis and first-principles calculation of the (√3×√3)R30° superlattice phase on the (111) surface of a Cu?9 at. %Al alloy. J. Vac. Sci. Technol. 28, 152-158. [Abstract]
  83. 高屋 茂、 根本 義之、 内一 哲哉、 欅田 理、 "漏えい磁束密度測定によるオーステナイト系ステンレス鋼の材料劣化診断" 、 日本AEM学会誌 17(1), p.156 - 161 (2009) [Abstract]
  84. J. D. Baniecki, M. Ishii, K. Kurihara, K. Yamanaka, T. Yano, K. Shinozaki, T. Imada, and Y. Kobayashi, "Chemisorption of water and carbon dioxide on nanostructured BaTiO3?SrTiO3(001) surfaces", Journal of Applied Physics 106, 054109 (2009). [Abstract]
  85. Mutsumi Nagata, Shinji Okamoto, Katsu Tanaka, and Akira Tamaki, "Photoluminescence of SrGa2S4:Mn Phosphors", ECS Trans. 16, 7-12 (2009). [Abstract]
  86. M. Nagata, S. Okamoto, K. Tanaka, T. Sakai, and A. Tamaki, "Green photoluminescence of SrGa2S4:Sn phosphors", phys. stat. sol. (a) 206, 2613-2616 (2009). [Abstract]
  87. Chikashi Suzuki, Yoichi Yamada, Toshio Nakagiri, "Evaluation for the configurational and electronic state of SO3 adsorbed on Pt surface", Applied Surface Science 256, 862-869 (2009). [Abstract]
  88. A. Kawasuso, Y. Fukaya, M. Hashimoto, A. Ichimiya, H. Narita, I. Matsuda, "Atomic Scale Study of Surface Structures and Phase Transitions with Reflection High-Energy Positron Diffraction", Materials Science Forum 607, 94-98 (2009). [Abstract]
  89. Eiichi Okuno, Toshio Sakakibara, Shoichi Onda, Makoto Itoh, and Tsuyoshi Uda (2009) Effect of Hydrogenation on the Dangling-Bond Free 4H-SiC(1120)/SiO2 Interface Studied by Ab Initio Calculations. Appl. Phys. Express 2,085503. [Abstract]
  90. Eiichi Okuno, Toshio Sakakibara, Shoichi Onda, Makoto Itoh, and Tsuyoshi Uda (2009) Ab initio theoretical study of an oxygen vacancy defect at the 4H-SiC(0001)/SiO2 interface. Phys. Rev. B 79, 113302. [Abstract]
  91. J Suda, O Kamishima, J Kawamura, T Hattori and T Sato, "Anharmonicity on Raman active phonon modes of LaAlO3", J. Phys.: Conf. Ser. 150 052249 (2009). [Abstract]
  92. Chikashi SUZUKI and Toshio NAKAGIRI, "Clarification of the Mechanism of Sulfur Trioxide Electrolysis--Evaluation of SO3 and O Atom Adsorbed on Pt Surface--", Journal of Nuclear Science and Technology 45, 1-9 (2008). [Abstract]
  93. Chikashi Suzuki and Toshio Nakagiri, "Sulfur trioxide adsorption on Pt surface", Advances in Quantum Chemistry 54, 61-79 (2008). [Abstract]
  94. Toshiyuki Matsunaga, Rie Kojima, Noboru Yamada, Kouichi Kifune, Yoshiki Kubota, and Masaki Takata, "Structural Features of Ge1Sb4Te7, an Intermetallic Compound in the GeTe-Sb2Te3 Homologous Series", Chemistry of Materials 20,5750-5755 (2008). [Abstract]
  95. Chikashi Suzuki, Toshio Nakagiri, "Investigation of SO3 adsorption and dissociation on Pt electrode", Solid State Ionics 179, 855-861 (2008). [Abstract]
  96. Y. Fukaya, M. Hashimoto, A. Kawasuso, A. Ichimiya, "Surface structure of Si(111)-(8×2) In determined by reflection high-energy positron diffraction" Surface Science 602, 2448-2452 (2008). [Abstract]
  97. M. Hashimoto, Y. Fukaya, A. Kawasuso, A. Ichimiya, "Quasi-one-dimensional In atomic chains on Si(111) at low temperature studied by reflection high-energy positron diffraction and scanning tunneling microscopy", Applied Surface Science 254, 7733-7736 (2008). [Abstract]
  98. K. Okamoto, S. Inoue, N. Matsuki, T.-W. Kim, J. Ohta, M. Oshima, H. Fujioka, and A. Ishii (2008) Epitaxial growth of GaN films grown on single crystal Fe substrates. Appl. Phys. Lett. 93, 251906. [Abstract] （著者の井上様よりAdvance/PHASEを利用したとのご連絡をいただきました）
  99. J. D. Baniecki, M. Ishii, K. Kurihara, K. Yamanaka, T. Yano, K. Shinozaki, T. Imada, K. Nozaki, and N. Kin (2008) Photoemission and quantum chemical study of SrTiO3(001) surfaces and their interaction with CO2. Phys. Rev. B 78, 195415. [Abstract]
  100. Eiichi Okuno, Toshio Sakakibara, Shoichi Onda, Makoto Itoh, and Tsuyoshi Uda (2008) First Principles Theoretical Study of 4H-SiC/SiO2 Interfacial Electronic States on (0001), (0001), and (1120). Appl. Phys. Express 1, 061401. [Abstract]
  101. Toshiyuki Matsunaga, Rie Kojima, Noboru Yamada, Kouichi Kifune, Yoshiki Kubota, and Masaki Takata (2007) Structural investigation of Ge3Sb2Te6, an intermetallic compound in the GeTe?Sb2Te3 homologous series. Appl. Phys. Lett. 90, 161919. [Abstract]
  102. J. Suda, O. Kamishima, J. Kawamura, T. Hattori and T. Sato, "Anharmonicity on Raman active phonon modes of LaGaO3" J. Phys.: Conf. Ser. 92, 012148 (2007). [Abstract]
  103. Toshiyuki Matsunaga, Rie Kojima, Noboru Yamada, Kouichi Kifune, Yoshiki Kubota, Yoshikazu Tabata, and Masaki Takata (2006) Single Structure Widely Distributed in a GeTe-Sb2Te3 Pseudobinary System: A Rock Salt Structure is Retained by Intrinsically Containing an Enormous Number of Vacancies within its Crystal. Inorg. Chem. 45, 2235-2241. [Abstract]

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第一原理計算ソフトウェア Advance/PHASEの基本機能
第一原理計算ソフトウェア Advance/PHASEの応用機能と解析事例
第一原理計算ソフトウェア Advance/PHASEの動作環境
PHASEを用いた学術論文
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