論文

• Masayuki Toyoda, Taisuke Ozaki. Exchange functional by a range-separated exchange hole, Physical Review A, Vol. 83, Mar. 2011.
• Taisuke Ozaki, Masayuki Toyoda. Accurate finite element method for atomic calculations based on density functional theory and Hartree-Fock method, Computer Physics Communications, Vol. 182, pp. 1245-1252, Mar. 2011.
• Masayuki Toyoda, Taisuke Ozaki. LIBERI: Library for Numerical Evaluation of Electron Repulsion Integrals, Computer Physics Communications, Vol. 181, pp. 1455-1463, Apr. 2010.
• Masayuki Toyoda, Taisuke Ozaki. Fast spherical Bessel transform via fast Fourier transform and recurrence formula, Computer Physics Communications, Vol. 181, pp. 277-282, Sept. 2009.
• Masayuki Toyoda, Taisuke Ozaki. Numerical Evaluation of Electron Repulsion Intergrals for Pseudoatomic Orbitals and Their Drivatives, Journal of Chemical Physics, Vol. 130, Mar. 2009.

国際会議発表 (査読なし・不明)

• Masayuki Toyoda, Taisuke Ozaki. Order-N method for calculation orbital-dependent exchange, The 14th Asian Workshop on First-Principles Electronic Structure Calculations, Nov. 2011.
• Masayuki Toyoda, Taisuke Ozaki. Exchange functional by a range-separated exchange hole, 14th International Density Functional Theory Conference, Sept. 2011.
• Masayuki Toyoda, Taisuke Ozaki. An exchange hole model for Hartree-Fock exchange energy, The 13th Asian Workshop on First-Principles Electronic Structure Calculations, Nov. 2010.
• Masayuki Toyoda, Taisuke Ozaki. New non-local exchange functional with range-separated exchnage hole, Psi-k Conference 2010, Sept. 2010.
• Masayuki Toyoda, Taisuke Ozaki. Hartree-Fock-type Exchange for Psuedo-atomic Orbitals, The 12th Asian Workshop on First-Principles Electronic Structure Calculations, Oct. 2009.
• Masayuki Toyoda, Taisuke Ozaki. Numerical Evaluation of Two-electron Four-Center Integrals for Psuedo-Atomic Orbitals, 13th International Conference on the Applications of Density Functional Theory in Chemistry and Physics, Sept. 2009.
• Masayuki Toyoda, Taisuke Ozaki. Numerical evaluation of four-center integrals for pseudoatomic orbitals, 14th International Workshop on Computational Physics and Materials Science: Total Energy and Force metdhos, Jan. 2009.
• Masayuki Toyoda, Taisuke Ozaki. Implementation of hybrid functional on OpenMX, The 11th Asian Workshop on First-Principles Electronic Structure Calculations, Nov. 2008.

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