Yoshiyuki Kawazoe

10PUBLICATIONS

29CO-AUTHORS

Reaction engineering (excl. nuclear reactions)Electrical energy generation (incl. renewables, excl. photovoltaics)Elemental semiconductorsFormal methods for softwarePhysical organic chemistry

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Publications (10)

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|Aug 19, 2026

Tuning surface electronic properties of Ni doped Cu2O catalyst toward highly selective nitrate-to-ammonia electroreduction.

|Dec 08, 2025

Enhancement of stability and electronic properties of ultra-high nickel cathodes by aluminium and boron codoping studied by combined density functional theory and neural network models.

Nguyen Vo Anh Duy, Tran Van Thien, Nguyen Thi Bao Trang

|Dec 04, 2025

Site-specific lithium adsorption and directional ion transport in Ti2CO2 MXenes: insights from nuclear magnetic resonance and climbing-image nudged elastic band calculations.

Truc Anh Nguyen, Nguyen Vo Anh Duy, Duong Trong Nhan

|Jul 15, 2025

Enhanced sodium-ion intercalation and migration in boron/carbon-doped WS2/graphene bilayers: insights from electronic structure calculations.

Thi Nhan Tran, Nguyen Hoang Son, Nguyen Minh Hieu

|Apr 24, 2025

Empowering materials science with VASPKIT: a toolkit for enhanced simulation and analysis.

Wen-Tong Geng, Ya-Chao Liu, Nan Xu

|Jan 06, 2025

Stabilization of small organic molecules on V2C and V2CO2 MXenes: first-principles insights into the performance of van der Waals functionals and the effect of oxygen vacancies.

Thong Nguyen-Minh Le, Thong Le Minh Pham, Thang Bach Phan

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Frequent Collaborators

Minh Triet Dang

Kaoru Ohno

Viet Bac Phung Thi

Nguyen Vo Anh Duy

Ryoji Sahara

Thong Nguyen-Minh Le

Phi Long Nguyen

Aaditya Manjanath

Trang Thuy Nguyen

Thang Bach Phan

Frequent Collaborators

Minh Triet Dang

Kaoru Ohno

Viet Bac Phung Thi

Nguyen Vo Anh Duy