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Issue DateTitleAuthor(s)
2018-03-01Electrocatalytic Activity of a 2D Phosphorene-Based Heteroelectrocatalyst for Photoelectrochemical CellsBatmunkh, M; Shrestha, A; Bat-Erdene, M; Nine, MJ; Shearer, CJ; Gibson, CT; Slattery, AD; Tawfik, SA; Ford, MJ; Dai, S; Qiao, S; Shapter, JG
2017-12-22Efficiency Enhancement of Single-Walled Carbon Nanotube-Silicon Heterojunction Solar Cells Using Microwave-Exfoliated Few-Layer Black PhosphorusBat-Erdene, M; Batmunkh, M; Tawfik, SA; Fronzi, M; Ford, MJ; Shearer, CJ; Yu, LP; Dadkhah, M; Gascooke, JR; Gibson, CT; Shapter, JG
2018-09-30Ab Initio Investigation of Water Adsorption and Hydrogen Evolution on Co<inf>9</inf>S<inf>8</inf> and Co<inf>3</inf>S<inf>4</inf> Low-Index SurfacesFronzi, M; Assadi, MHN; Ford, MJ
2008-07-23First principles calculations using density matrix divide-and-conquer within the SIESTA methodologyCankurtaran, BO; Gale, JD; Ford, MJ
2004-06-08Trends in the band structures of the group-I and -II oxidesMikajlo, EA; Dorsett, HE; Ford, MJ
2019-01-01Efficient Prediction of Structural and Electronic Properties of Hybrid 2D Materials Using Complementary DFT and Machine Learning ApproachesTawfik, SA; Isayev, O; Stampfl, C; Shapter, J; Winkler, DA; Ford, MJ
2006-07-01Implementation of a Z-matrix approach within the SIESTA periodic boundary conditions code and its application to surface adsorptionHoft, RC; Gale, JD; Ford, MJ
2018-03-22Evaluation of van der Waals density functionals for layered materialsTawfik, SA; Gould, T; Stampfl, C; Ford, MJ
2006-12-01Adsorption and dimerisation of thiol molecules on Au(111) using a Z-matrix approach in density functional theoryFord, MJ; Hoft, RC; Gale, JD
2019-01-01Structure, stability and water adsorption on ultra-thin TiO<inf>2</inf> supported on TiNGutiérrez Moreno, JJ; Fronzi, M; Lovera, P; O'Riordan, A; Ford, MJ; Li, W; Nolan, M
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