Taisuke Ozaki

发表

OpenFFT Version 1.1 User Guide

Truong Vinh Truong Duy, Taisuke Ozaki, 2014 .

Fast spherical Bessel transform via fast Fourier transform and recurrence formula

Taisuke Ozaki, Masayuki Toyoda, T. Ozaki, 2010, Comput. Phys. Commun..

LIBERI: Library for numerical evaluation of electron-repulsion integrals

Taisuke Ozaki, Masayuki Toyoda, 2010, Comput. Phys. Commun..

A three-dimensional domain decomposition method for large-scale DFT electronic structure calculations

Truong Vinh Truong Duy, Taisuke Ozaki, T. Ozaki, 2012, Comput. Phys. Commun..

Performance Tuning of a Parallel 3-D FFT Package OpenFFT

Truong Vinh Truong Duy, Taisuke Ozaki, 2015 .

Accurate finite element method for atomic calculations based on density functional theory and Hartree-Fock method

Taisuke Ozaki, Masayuki Toyoda, T. Ozaki, 2011, Comput. Phys. Commun..

A decomposition method with minimal communication volume for parallelization of multi-dimensional FFTs

Truong Vinh Truong Duy, Taisuke Ozaki, 2013, ICS '13.

A decomposition method with minimum communication amount for parallelization of multi-dimensional FFTs pdf

Truong Vinh Truong Duy, Taisuke Ozaki, 2014, Comput. Phys. Commun..

OpenMX Viewer: A web-based crystalline and molecular graphical user interface program

Taisuke Ozaki, Yung-Ting Lee, T. Ozaki, 2019, Journal of molecular graphics & modelling.

Performance Tuning of an Open-Source Parallel 3-D FFT Package OpenFFT pdf

Truong Vinh Truong Duy, Taisuke Ozaki, T. Ozaki, 2015, ArXiv.

A massively parallel domain decomposition method for large-scale DFT electronic structure calculations

Truong Vinh Truong Duy, Taisuke Ozaki, 2013, ICS '13.

Hybrid and 4-D FFT implementations of an open-source parallel FFT package OpenFFT

Truong Vinh Truong Duy, Taisuke Ozaki, 2015, The Journal of Supercomputing.

A method of orbital analysis for large-scale first-principles simulations.

Taisuke Ozaki, Minoru Otani, T. Ozaki, 2014, The Journal of chemical physics.

Efficient implementation of the nonequilibrium Green function method for electronic transport calculations

Taisuke Ozaki, Hiori Kino, Kengo Nishio, 2009, 0908.4142.

Numerical atomic basis orbitals from H to Kr

Taisuke Ozaki, Hiori Kino, T. Ozaki, 2004 .

BOND-ORDER POTENTIAL BASED ON THE LANCZOS BASIS

Taisuke Ozaki, 1999 .

Continued fraction representation of the Fermi-Dirac function for large-scale electronic structure calculations

Taisuke Ozaki, T. Ozaki, 2007 .

Variationally optimized atomic orbitals for large-scale electronic structures

Taisuke Ozaki, T. Ozaki, 2003 .

O(N) Krylov-subspace method for large-scale ab initio electronic structure calculations

Taisuke Ozaki, 2006 .

Unfolding method for first-principles LCAO electronic structure calculations

Chi-Cheng Lee, Taisuke Ozaki, Yukiko Yamada-Takamura, 2012, Journal of physics. Condensed matter : an Institute of Physics journal.

Efficient low-order scaling method for large-scale electronic structure calculations with localized basis functions

Taisuke Ozaki, T. Ozaki, 2010 .

O ( N ) LDA + U electronic structure calculation method based on the nonorthogonal pseudoatomic orbital basis

Taisuke Ozaki, Myung Joon Han, Jaejun Yu, 2006 .

Large-scale first-principles molecular dynamics for electrochemical systems with O(N) methods.

Taisuke Ozaki, Tamio Ikeshoji, Minoru Otani, 2012, The Journal of chemical physics.

First-principles study of interface structure and energy of Fe/NbC

Taisuke Ozaki, Hideaki Sawada, Kazuto Kawakami, 2013 .

Efficient recursion method for inverting an overlap matrix

Taisuke Ozaki, T. Ozaki, 2001 .

Efficient projector expansion for the ab initio LCAO method

Taisuke Ozaki, Hiori Kino, T. Ozaki, 2005 .

Experimental evidence for epitaxial silicene on diboride thin films.

Hiroyuki Kawai, Taisuke Ozaki, Rainer Friedlein, 2012, Physical review letters.

Numerical evaluation of electron repulsion integrals for pseudoatomic orbitals and their derivatives.

Taisuke Ozaki, Masayuki Toyoda, 2009, The Journal of chemical physics.