Kyohei Yoneda

(Hyper)polarizability density analysis for open-shell molecular systems based on natural orbitals and occupation numbers

Masayoshi Nakano, Hitoshi Fukui, Takuya Minami et al. · Theoretical Chemistry Accounts · 2011 · 139 citations

Engineering, Occupation Numbers, Physics +10

Giant Enhancement of the Second Hyperpolarizabilities of Open-Shell Singlet Polyaromatic Diphenalenyl Diradicaloids by an External Electric Field and Donor–Acceptor Substitution

Masayoshi Nakano, Takuya Minami, Kyohei Yoneda et al. · The Journal of Physical Chemistry Letters · 2011 · 118 citations · Full text

Organic Charge-transfer Compound, Giant Enhancement, Engineering +14

Signature of multiradical character in second hyperpolarizabilities of rectangular graphene nanoflakes

Hiroshi Nagai, Masayoshi Nakano, Kyohei Yoneda et al. · Chemical Physics Letters · 2010 · 97 citations

Materials Science, Graphene Nanomeshes, Graphene-based Nano-antennas +15

Theoretical study of third-order nonlinear optical properties in square nanographenes with open-shell singlet ground states

Masayoshi Nakano, Hiroshi Nagai, Hitoshi Fukui et al. · Chemical Physics Letters · 2008 · 95 citations

Quantum Science, Square Nanographenes, Graphene-based Nano-antennas +14

Long-range corrected density functional theory study on static second hyperpolarizabilities of singlet diradical systems

Ryohei Kishi, Sean Bonness, Kyohei Yoneda et al. · The Journal of Chemical Physics · 2010 · 94 citations

Spectral Theory, Engineering, Diradical Character Dependence +18