Insertion energetics of lithium, sodium, and magnesium in crystalline and amorphous titanium dioxide: A comparative first-principles study

by Legrain Fleur, Malyi Oleksandr, Manzhos Sergei
Published 2016

A computational study of the insertion of Li, Na, and Mg atoms into Si(111) nanosheets

by Manzhos, Sergei, Kulish, Vadym V., Tan, Teck L., Malyi, Oleksandr I.
Published 2013

Density functional theory study of sulfur tolerance of copper : new copper–sulfur phase diagram

by Malyi, Oleksandr I., Kulish, Vadym V., Bai, Kewu, Wu, Ping, Chen, Zhong
Published 2013

A computational study of the effect of alloying additions on the stability of Ni/c-ZrO2 interfaces

by Malyi, Oleksandr I., Kulish, Vadym V., Bai, Kewu, Wu, Ping, Chen, Zhong
Published 2013

Formation and migration of oxygen and zirconium vacancies in cubic zirconia and zirconium oxysulfide

by Kulish, Vadym V., Malyi, Oleksandr I., Wu, Ping, Bai, Kewu, Chen, Zhong
Published 2013

Enhanced Li adsorption and diffusion in single-walled silicon nanotubes : an ab initio study

by Kulish, Vadym V., Ng, Man-Fai, Malyi, Oleksandr I., Wu, Ping, Chen, Zhong
Published 2014

Controlling Na diffusion by rational design of Si-based layered architectures

by Kulish, Vadym V., Malyi, Oleksandr I., Ng, Man-Fai, Chen, Zhong, Manzhos, Sergei, Wu, Ping
Published 2014

A computational study of Na behavior on graphene

by Malyi, Oleksandr I., Sopiha, Kostiantyn, Kulish, Vadym V., Tan, Teck L., Manzhos, Sergei, Persson, Clas
Published 2016

Deep cycling for high‐capacity Li‐ion batteries

by Xia, Huarong, Tang, Yuxin, Malyi, Oleksandr I., Zhu, Zhiqiang, Zhang, Yanyan, Zhang, Wei, Ge, Xiang, Zeng, Yi, Chen, Xiaodong
Published 2021

Lifshitz interaction can promote ice growth at water-silica interfaces

by Boström, Mathias, Malyi, Oleksandr I., Parashar, Prachi, Shajesh, K. V., Thiyam, Priyadarshini, Milton, Kimball A., Persson, Clas, Parsons, Drew F., Brevik, Iver
Published 2017

Understanding the role of nanostructures for efficient hydrogen generation on immobilized photocatalysts

by Jiang, Zhelong, Tang, Yuxin, Tay, Qiuling, Zhang, Yanyan, Malyi, Oleksandr I., Wang, Danping, Deng, Jiyang, Lai, Yuekun, Zhou, Huanfu, Chen, Xiaodong, Dong, Zhili, Chen, Zhong
Published 2013

Identifying the origin and contribution of surface storage in TiO2 (B) nanotube electrode by in situ dynamic valence state monitoring

by Tang, Yuxin, Zhang, Yanyan, Malyi, Oleksandr I., Bucher, Nicolas, Xia, Huarong, Xi, Shibo, Zhu, Zhiqiang, Lv, Zhisheng, Li, Wenlong, Wei, Jiaqi, Srinivasan, Madhavi, Borgna, Armando, Antonietti, Markus, Du, Yonghua, Chen, Xiaodong
Published 2020

Direct coherent multi-ink printing of fabric supercapacitors

by Zhao, Jingxin, Lu, Hongyu, Zhang, Yan, Yu, Shixiong, Malyi, Oleksandr I., Zhao, Xiaoxin, Wang, Litong, Wang, Huibo, Peng, Jianhong, Li, Xifei, Zhang, Yanyan, Chen, Shi, Pan, Hui, Xing, Guichuan, Lu, Conghua, Tang, Yuxin, Chen, Xiaodong
Published 2021