Hiroyuki Maeshima

Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization

T. Ando, Naoto Shimizu, Norihisa Yamamoto et al. · The Journal of Physical Chemistry A · 2022 · 34 citations

Natural Sciences, Chemistry, Materials Science +17

Quantitative Evaluation of Electrochemical Potential Windows of Electrolytes for Electric Double-Layer Capacitors Using Ab Initio Calculations

Hiroyuki Maeshima, Hiroki Moriwake, Akihide Kuwabara et al. · Journal of The Electrochemical Society · 2010 · 33 citations

Natural Sciences, Chemical Engineering, Chemistry +17

Magnetic resonance lymphography of sentinel lymph nodes in patients with breast cancer using superparamagnetic iron oxide: a feasibility study

Mikio Shiozawa, Shigeru Kobayashi, Yugo Sato et al. · Breast Cancer · 2012 · 26 citations

Medicine, Oncology, Radiology +17

<i>De Novo</i> Design of Molecules with Low Hole Reorganization Energy Based on a Quarter-Million Molecule DFT Screen

Gabriel Marques, Karl Leswing, Tim Robertson et al. · The Journal of Physical Chemistry A · 2021 · 25 citations

Natural Sciences, Chemistry, Materials Science +15

Spin polarized band structure of Cu3Au-type compounds MPt3 (MV, Cr, Mn, Fe, Co)

Masafumi Shirai, Hiroyuki Maeshima, Naoshi Suzuki · Journal of Magnetism and Magnetic Materials · 1995 · 22 citations

Natural Sciences, Chemistry, Materials Science +12