Hiroyuki Maeshima

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

N. Matsuzawa, Naoto Shimizu, Tatsuhito Ando, 2022, The journal of physical chemistry. A.

De Novo Design of Molecules with Low Hole Reorganization Energy Based on a Quarter-Million Molecule DFT Screen: Part 2.

M. Halls, K. Leswing, A. Goldberg, 2022, The journal of physical chemistry. A.

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

N. Suzuki, M. Shirai, Hiroyuki Maeshima, 1995 .

An Improved Method for Quantitatively Predicting the Electrochemical Stabilities of Organic Liquid Electrolytes Using Ab Initio Calculations

A. Kuwabara, C. Fisher, H. Moriwake, 2014 .

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

A. Kuwabara, C. Fisher, H. Moriwake, 2010 .

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

N. Sata, A. Lefor, Y. Hozumi, 2014, Breast Cancer.

De Novo Design of Molecules with Low Hole Reorganization Energy Based on a Quarter-Million Molecule DFT Screen.

M. Halls, E. Fujii, K. Leswing, 2021, The journal of physical chemistry. A.