UTChem - A Program for ab initio Quantum Chemistry. - Takeshi Yanai; Haruyuki Nakano; Takahito Nakajima; Takao Tsuneda; So Hirata; Yukio Kawashima; Yoshihide Nakao; Muneaki Kamiya; Hideo Sekino; Kimihiko Hirao (International Conference on Computational Science, 2003)

Theoretical study on the molecular structures of X-, α-, and β-types of lithium phthalocyanine dimer. - Michinori Sumimoto; Yukio Kawashima; Daisuke Yokogawa; Kenji Hori; Hitoshi Fujimoto (J. Comput. Chem., 2011)

Nuclear quantum effect and temperature dependency on the hydrogen-bonded structure of base pairs. - Masashi Daido; Yukio Kawashima; Masanori Tachikawa (J. Comput. Chem., 2013)

Toward the complete range separation of non-hybrid exchange-correlation functional. - Bun Chan; Jong-Won Song; Yukio Kawashima; Kimihiko Hirao (J. Comput. Chem., 2015)

Performance of the OP correlation functional in relation to its formulation: Influence of the exchange component and the effect of incorporating same-spin correlations. - Bun Chan; Jong-Won Song; Yukio Kawashima; Kimihiko Hirao (J. Comput. Chem., 2016)

Correlation functional in screened-exchange density functional theory procedures. - Bun Chan; Yukio Kawashima; Kimihiko Hirao (J. Comput. Chem., 2017)

Solvatochromism and preferential solvation of Brooker's merocyanine in water-methanol mixtures. - Yuichi Tanaka 002; Yukio Kawashima; Norio Yoshida; Haruyuki Nakano (J. Comput. Chem., 2017)

The reHISS Three-Range Exchange Functional with an Optimal Variation of Hartree-Fock and Its Use in the reHISSB-D Density Functional Theory Method. - Bun Chan; Yukio Kawashima; Kimihiko Hirao (J. Comput. Chem., 2019)

A path integral molecular dynamics study on intermolecular hydrogen bond of acetic acid-arsenic acid anion and acetic acid-phosphoric acid anion clusters. - Yukio Kawashima; Keisuke Sawada; Takahito Nakajima; Masanori Tachikawa (J. Comput. Chem., 2019)