Update: 13 May 2021

籾田 浩義
大阪大学産業科学研究所 助教
産業科学ナノテクノロジーセンター
ナノ機能予測研究分野(小口研究室)

Hiroyoshi Momida
Assistant Professor
Department of Theoretical Nanotechnology
Nanoscience and Nanotechnology Center
Institute of Scientific and Industrial Research
Osaka University, Japan

Publications
  1. Huu Duc Luong, Van An Dinh, Hiroyoshi Momida, and Tamio Oguchi,
    Tavorite-like orthorhombic AxVPO4F (A = Li, Na) for novel high-voltage cathodes in rechargeable batteries,
    J. Alloys Compd. 875, 159963/1-10 (2021).
    https://doi.org/10.1016/j.jallcom.2021.159963

  2. Hung Ba Tran, Tetsuya Fukushima, Hiroyoshi Momida, Kazunori Sato, Yukihiro Makino, and Tamio Oguchi,
    Theoretical prediction of large anisotropic magnetocaloric effect in MnP,
    Comput. Mater. Sci. 188, 110227/1-8 (2021).
    https://doi.org/10.1016/j.commatsci.2020.110227

  3. Hiroyoshi Momida and Takahisa Ohno,
    Bistability and metastability of oxygen vacancies in amorphous Al2O3: A possible origin of resistance switching mechanism,
    Appl. Phys. Lett. 117, 103504/1-5 (2020).
    https://doi.org/10.1063/5.0021627

  4. Huu Duc Luong, Van An Dinh, Hiroyoshi Momida, and Tamio Oguchi,
    Insight into the diffusion mechanism of sodium ion-polaron complexes in orthorhombic P2 layered cathode oxide NaxMnO2,
    Phys. Chem. Chem. Phys. 22, 18219-18228 (2020).
    https://doi.org/10.1039/D0CP03208E

  5. Motoyuki Hamaguchi, Hiroyoshi Momida, Ayuko Kitajou, Shigeto Okada, and Tamio Oguchi,
    Suppression of O-redox reactions by multivalent Cr in Li-excess Li2.4M0.8M'0.8O4 (M, M' = Cr, Mn, and Ti) cathodes with layered and cation-disordered rock-salt structures,
    Electrochimica Acta 354, 136630/1-9 (2020).
    https://doi.org/10.1016/j.electacta.2020.136630

  6. Motoyuki Hamaguchi, Hiroyoshi Momida, and Tamio Oguchi,
    Significant role of oxygen redox reaction with O2-release in Li-excess cation-disordered rock-salt cathodes Li2+2xMn1-xTi1-xO4: First-principles calculations,
    Electrochimica Acta 330, 135286/1-8 (2020).
    https://doi.org/10.1016/j.electacta.2019.135286

  7. 濱口基之、籾田浩義、小口多美夫,
    第一原理計算による不規則岩塩型リチウムイオン電池正極材料の電子状態の解析,
    「リチウムイオン電池の分析、解析と評価技術 事例集」(第1章, 第3節, 分担執筆), (技術情報協会, 2019年11月29日発刊), pp.23-38. [Book chapter in Japanese]
    https://www.gijutu.co.jp/doc/b_2036.htm

  8. Hiroyoshi Momida, Ayuko Kitajou, Shigeto Okada, and Tamio Oguchi,
    First-principles study of x-ray absorption spectra in NaFeSO4F for exploring Na-ion battery reactions,
    J. Phys. Soc. Jpn. 88, 124709/1-6 (2019).
    https://doi.org/10.7566/JPSJ.88.124709

  9. Ayuko Kitajou, Hiroyoshi Momida, Takahiro Yamashita, Tamio Oguchi, and Shigeto Okada,
    Amorphous xNaF-FeSO4 systems (1 ≤ x ≤ 2) with excellent cathode properties for sodium-ion batteries,
    ACS Appl. Energy Mater. 2, 5968-5974 (2019).
    https://doi.org/10.1021/acsaem.9b01053

  10. Boyi Zhang, Rodrigo Sato, Hiroyoshi Momida, Takahisa Ohno, Mykhailo Chundak, Masanobu Naito, Michiko Yoshitake, and Yoshihiko Takeda,
    Spectral dependence of the third-order optical susceptibility of Au nanostructures: Experiments and first-principles calculations,
    Phys. Rev. B 100, 035446/1-9 (2019).
    https://doi.org/10.1103/PhysRevB.100.035446

  11. Hiroki Kotaka, Hiroyoshi Momida, Ayuko Kitajou, Shigeto Okada, and Tamio Oguchi,
    First-principles study of Na-ion battery performance and reaction mechanism of tin sulfide as negative electrode,
    Chem. Rec. 19, 811-816 (2019).
    https://doi.org/10.1002/tcr.201800167

  12. 小鷹浩毅、籾田浩義、喜多條鮎子、岡田重人、小口多美夫,
    第一原理計算を用いた硫化スズ電極のNaイオン電池性能評価と放電機構解明,
    J. Comput. Chem. Jpn. 18, 78-83 (2019). [Refereed paper in Japanese]
    https://doi.org/10.2477/jccj.2018-0041
    Selected for the SCCJ 2019 Best Paper Award / 日本コンピュータ化学会2019年度吉田賞(論文賞)(12 June 2020)

  13. Motoyuki Hamaguchi, Hiroyoshi Momida, and Tamio Oguchi,
    First-principles study on cathode properties of Li2MTiO4 (M = V, Cr, Mn, Fe, Co, and Ni) with oxygen deficiency for Li-ion batteries,
    J. Phys. Soc. Jpn. 87, 044805/1-8 (2018).
    https://doi.org/10.7566/JPSJ.87.044805

  14. Masayuki Fukuichi, Hiroyoshi Momida, Masaaki Geshi, Masato Michiuchi, Koichi Sogabe, and Tamio Oguchi,
    First-principles calculations on the origin of mechanical properties and electronic structures of 5d transition metal monocarbides MC (M = Hf, Ta, W, Re, Os, Ir, and Pt),
    J. Phys. Soc. Jpn. 87, 044602/1-8 (2018).
    https://doi.org/10.7566/JPSJ.87.044602

  15. Hiroyoshi Momida and Tamio Oguchi,
    Effects of lattice parameters on piezoelectric constants in wurtzite materials: A theoretical study using first-principles and statistical-learning methods,
    Appl. Phys. Express 11, 041201/1-4 (2018).
    https://doi.org/10.7567/APEX.11.041201

  16. Hiroyoshi Momida, Gustav Bihlmayer, Stefan Blügel, Kouji Segawa, Yoichi Ando, and Tamio Oguchi,
    Topological interface states in the natural heterostructure (PbSe)5(Bi2Se3)6 with BiPb defects,
    Phys. Rev. B 97, 035113/1-6 (2018).
    https://doi.org/10.1103/PhysRevB.97.035113

  17. Ayuko Kitajou, Yuji Ishado, Tomoki Yamashita, Hiroyoshi Momida, Tamio Oguchi, and Shigeto Okada,
    Cathode properties of perovskite-type NaMF3 (M = Fe, Mn, and Co) prepared by mechanical ball milling for sodium-ion battery,
    Electrochimica Acta 245, 424-429 (2017).
    https://doi.org/10.1016/j.electacta.2017.05.153

  18. Nayoung Song, Hiroyoshi Momida, Tamio Oguchi, and Bog G. Kim,
    Polar phase transitions and physical properties in fresnoite A2TiSi2O8 (A = Ba, Sr) by first principles calculations,
    J. Solid State Chem. 242, 136-142 (2016).
    https://doi.org/10.1016/j.jssc.2016.06.016

  19. Hiroyoshi Momida, Akihiko Teshigahara, and Tamio Oguchi,
    Strong enhancement of piezoelectric constants in ScxAl1-xN: First-principles calculations,
    AIP Advances 6, 065006/1-11 (2016).
    https://doi.org/10.1063/1.4953856

  20. Tomoki Yamashita, Hiroyoshi Momida, and Tamio Oguchi,
    Crystal structure predictions of NaxC6O6 for sodium-ion batteries: First-principles calculations with an evolutionary algorithm,
    Electrochimica Acta 195, 1-8 (2016).
    https://doi.org/10.1016/j.electacta.2016.02.056

  21. Hiroyoshi Momida, Ayuko Kitajou, Shigeto Okada, Tomoki Yamashita, and Tamio Oguchi,
    Discharge reaction mechanisms in Na/FeS2 batteries: First-principles calculations,
    J. Phys. Soc. Jpn. 84, 124709/1-6 (2015).
    https://doi.org/10.7566/JPSJ.84.124709

  22. 小口多美夫、籾田浩義、山下智樹,
    第一原理計算の二次電池材料設計への応用,
    エネルギーデバイス (2015年10月号, 技術情報協会) 3(1), 55-58 (2015). [Article in Japanese]
    https://www.gijutu.co.jp/weblibraryadv/weblibrarymagazine.htm (electronic file not available)

  23. 籾田浩義、山下智樹、小口多美夫,
    電子論からみたナトリウム硫黄2次電池の充放電機構,
    固体物理 50(6), 47-58 (2015). [Article in Japanese]
    http://www.agne.co.jp/kotaibutsuri/kota1050.htm#no592/ (electronic file not available)

  24. Tomoki Yamashita, Hiroyoshi Momida, and Tamio Oguchi,
    First-principles investigation of a phase transition in NaxC6O6 as an organic cathode material for Na-ion batteries: Role of intermolecule bonding of C6O6,
    J. Phys. Soc. Jpn. 84, 074703/1-7 (2015).
    https://doi.org/10.7566/JPSJ.84.074703

  25. Hiroyoshi Momida, Tomoki Yamashita, and Tamio Oguchi,
    First-principles study on structural and electronic properties of α-S and Na-S crystals,
    J. Phys. Soc. Jpn. 83, 124713/1-8 (2014).
    https://doi.org/10.7566/JPSJ.83.124713
    Selected for the Papers of Edirot's Choice / JPSJ注目論文 (in Japanese)

  26. Hitoshi Fujii, Masayuki Toyoda, Hiroyoshi Momida, Masaichiro Mizumaki, Shigeru Kimura, and Tamio Oguchi,
    Ab initio study of electronic, magnetic, and spectroscopic properties in A- and B-site-ordered perovskite CaCu3Fe2Sb2O12,
    Phys. Rev. B 90, 014430/1-8 (2014).
    https://doi.org/10.1103/PhysRevB.90.014430

  27. Hiroyoshi Momida, Yusuke Asari, Yoshimichi Nakamura, Yoshitaka Tateyama, and Takahisa Ohno,
    Hydrogen-enhanced vacancy embrittlement of grain boundaries in iron,
    Phys. Rev. B 88, 144107/1-13 (2013).
    https://doi.org/10.1103/PhysRevB.88.144107
    Selected for the PRB Kaleidoscope (October 2013)

  28. Tamio Oguchi and Hiroyoshi Momida,
    First-principles study of x-ray absorption spectra of FeS2,
    J. Phys. Soc. Jpn. 82, 065004/1-2 (2013).
    https://doi.org/10.7566/JPSJ.82.065004

  29. Moon Young Yang, Katsumasa Kamiya, Blanka Magyari-Köpe, Hiroyoshi Momida, Takahisa Ohno, Masaaki Niwa, Yoshio Nishi, and Kenji Shiraishi,
    Physical guiding principles for high quality resistive random access memory stack with Al2O3 insertion layer,
    Jpn. J. Appl. Phys. 52, 04CD11/1-4 (2013).
    https://doi.org/10.7567/JJAP.52.04CD11

  30. Rodrigo Sato, Hiroyoshi Momida, Masato Ohnuma, Masato Sasase, Takahisa Ohno, Naoki Kishimoto, and Yoshihiko Takeda,
    Experimental dispersion of the third order optical susceptibility of Ag nanoparticles,
    J. Opt. Soc. Am. B 29, 2410-2413 (2012).
    https://doi.org/10.1364/JOSAB.29.002410

  31. Hiroyoshi Momida, Seisuke Nigo, Giyuu Kido, and Takahisa Ohno,
    Effect of vacancy-type oxygen deficiency on electronic structure in amorphous alumina,
    Appl. Phys. Lett. 98, 042102/1-3 (2011).
    https://doi.org/10.1063/1.3548549

  32. Hiroyoshi Momida, Eric Cockayne, Naoto Umezawa, and Takahisa Ohno,
    Computational study of the dielectric properties of [La, Sc]2O3 solid solutions,
    J. Appl. Phys. 107, 074104/1-3 (2010).
    https://doi.org/10.1063/1.3360935

  33. Yoshihiko Takeda, Hiroyoshi Momida, Masato Ohnuma, Takahisa Ohno, and Naoki Kishimoto,
    Wavelength dispersion of nonlinear dielectric function of Cu nanoparticle materials,
    Optics Express 16, 7471-7480 (2008).
    https://doi.org/10.1364/OE.16.007471

  34. Hiroyoshi Momida, Tomoyuki Hamada, Takahisa Ohno,
    First-principles study of dielectric properties of amorphous high-k materials,
    Jpn. J. Appl. Phys. 46, 3255-3260 (2007).
    https://doi.org/10.1143/JJAP.46.3255

  35. Hiroyoshi Momida, Tomoyuki Hamada, Yoshiteru Takagi, Takenori Yamamoto, Tsuyoshi Uda, and Takahisa Ohno,
    Dielectric constants of amorphous hafnium aluminates: First-principles study,
    Phys. Rev. B 75, 195105/1-10 (2007).
    https://doi.org/10.1103/PhysRevB.75.195105

  36. Naoto Umezawa, Kenji Shiraishi, Seiichi Miyazaki, Akira Uedono, Yasushi Akasaka, Seiji Inumiya, Ryu Hasunuma, Kikuo Yamabe, Hiroyoshi Momida, Takahisa Ohno, Kenji Ohmori, Toyohiro Chikyow, Yasuo Nara, and Keisaku Yamada,
    Guiding principle of energy level controllability of silicon dangling bonds in HfSiON,
    Jpn. J. Appl. Phys. 46, 1891-1894 (2007).
    https://doi.org/10.1143/JJAP.46.1891

  37. Takenori Yamamoto, Junichiro Koga, Mamoru Usami, Tsuyoshi Uda, Hiroyoshi Momida, Takahiro Yamasaki, and Takahisa Ohno,
    Very large-scale first-principles simulation on Earth Simulator: Application to the multi-valley splitting of the 1s ground state of As donor in Si,
    AIP Conf. Proc. 893, 215-216 (2007).
    https://doi.org/10.1063/1.2729845

  38. Naoto Umezawa, Kenji Shiraishi, Seiichi Miyazaki, Akira Uedono, Yasushi Akasaka, Seiji Inumiya, Atsushi Oshiyama, Ryu Hasunuma, Kikuo Yamabe, Hiroyoshi Momida, Takahisa Ohno, Kenji Ohmori, Toyohiro Chikyow, Yasuo Nara, and Keisaku Yamada,
    Role of the ionicity in defect formation in Hf-based dielectrics,
    ECS Trans. 11, 199-211 (2007).
    https://doi.org/10.1149/1.2779561

  39. Hiroyoshi Momida, Tomoyuki Hamada, Takenori Yamamoto, Tsuyoshi Uda, Naoto Umezawa, Toyohiro Chikyow, Kenji Shiraishi, and Takahisa Ohno,
    Effects of nitrogen atom doping on dielectric constants of Hf-based gate oxides,
    Appl. Phys. Lett. 88, 112903/1-3 (2006).
    https://doi.org/10.1063/1.2184991

  40. Hiroyoshi Momida, Tomoyuki Hamada, Yoshiteru Takagi, Takenori Yamamoto, Tsuyoshi Uda, and Takahisa Ohno,
    Theoretical study on dielectric response of amorphous alumina,
    Phys. Rev. B 73, 054108/1-10 (2006).
    https://doi.org/10.1103/PhysRevB.73.054108

  41. T. Hamada, T. Yamamoto, H. Momida, T. Uda, T. Ohno, N. Tajima, S. Hasaka, M Inoue, N. Kobayashi,
    Development of universal virtual spectroscope for opto-electronics research: First-principles software replacing dielectric constant measurements,
    in "Foundations of Quantum Mechanics in the Light of New Technology" edited by S. Ishioka and K. Fujikawa, (World Scientific Publishing, 2006) pp.262-265.
    https://doi.org/10.1142/9789812773210_0056

  42. Hiroyoshi Momida, Takenori Yamamoto, Tomoyuki Hamada, Yoshiteru Takagi, Tsuyoshi Uda, and Takahisa Ohno,
    First-principles study on dielectric response of amorphous Al2O3,
    Trans. Mat. Res. Soc. Jpn. 30, 889-892 (2005).
    http://mrs-j.org/ (electronic file not available)

  43. Takenori Yamamoto, Hiroyoshi Momida, Tomoyuki Hamada, Tsuyoshi Uda, and Takahisa Ohno,
    First-principles study of dielectric properties of cerium oxide,
    Thin Solid Films 486, 136-140 (2005).
    https://doi.org/10.1016/j.tsf.2004.11.240

  44. Hiroyoshi Momida and Tamio Oguchi,
    First-principles study on exchange force image of NiO(001) surface using a ferromagnetic Fe probe,
    Surf. Sci. 590, 42-50 (2005).
    https://doi.org/10.1016/j.susc.2005.06.006

  45. 小口多美夫、籾田浩義,
    反強磁性酸化物表面の電子状態と磁性:第一原理計算,
    表面科学 26, 138-143 (2005). [Article in Japanese]
    https://doi.org/10.1380/jsssj.26.138

  46. Hiroyoshi Momida and Tamio Oguchi,
    Exchange force image of magnetic surfaces --A first-principles study on NiO(001) surface--,
    in "Physics of Spin in Solids: Materials, Methods and Applications" edited by Samed Halilov, (Kluwer Academic Publishers, 2004) pp.17-24.
    https://doi.org/10.1007/1-4020-2708-7_2

  47. Hiroyoshi Momida and Tamio Oguchi,
    First-principles studies of antiferromagnetic MnO and NiO surfaces,
    J. Phys. Soc. Jpn. 72, 588-593 (2003).
    https://doi.org/10.1143/JPSJ.72.588

  48. Hiroyoshi Momida and Tamio Oguchi,
    Electronic structure and magnetism of Cr/Sn multilayer systems,
    J. Magn. Magn. Mater. 234, 126-132 (2001).
    https://doi.org/10.1016/S0304-8853(01)00285-2

Press reports

Others

Link: Oguchi Lab. (Japanese / English), ISIR (Japanese / English), Osaka Univ. (Japanese / English)