Nano Research Hybrid Editors-in-Chief: Yadong Li, Shoushan Fan
Keyword: density functional theory
Research Article
Theoretical investigations of transport properties of organic solvents in cation-functionalized graphene oxide membranes: Implications for drug delivery
Published: 09 June 2017
2018, 11(1): 254-263
Research Article
Hybridized electronic states between CdSe nanoparticles and conjugated organic ligands: A theoretical and ultrafast photo-excited carrier dynamics study
Published: 02 August 2017
2018, 11(1): 142-150
Research Article
A systematic theoretical study on FeOx-supported single-atom catalysts: M1/FeOx for CO oxidation
Published: 02 February 2018
2018, 11(3): 1599-1611
Research Article
Theory-guided construction of electron-deficient sites via removal of lattice oxygen for the boosted electrocatalytic synthesis of ammonia
Published: 02 November 2020
2021, 14(5): 1457-1464
Research Article
Hexagonal boron nitride nanosheet for effective ambient N2 fixation to NH3
Published: 07 March 2019
2019, 12(4): 919-924
Research Article
Formation mechanism of twin domain boundary in 2D materials: The case for WTe2
Published: 12 December 2018
2019, 12(3): 569-573
Review Article
Two-dimensional MoS2 for hydrogen evolution reaction catalysis: The electronic structure regulation
Published: 04 December 2020
2021, 14(6): 1985-2002
Research Article
Ternary Ni-Co-Fe oxyhydroxide oxygen evolution catalysts: Intrinsic activity trends, electrical conductivity, and electronic band structure
Published: 13 April 2019
2019, 12(9): 2288-2295
Research Article
Single and multi domain buckled germanene phases on Al(111) surface
Published: 25 October 2019
2019, 12(12): 2988-2996
Research Article
Self-supporting nanoporous gold-palladium overlayer bifunctional catalysts toward oxygen reduction and evolution reactions
Published: 26 September 2016
2016, 9(12): 3781-3794
Total 92