P. Koh

collaborators

2 papers

cond-mat.mtrl-sci2019

Generation of ground state structures and electronic properties of ternary Al $_{x}$ Ti $_{y}$ Ni $_{z}$ clusters (x+y+z=6) with a two-stage DFT global search approach

Pin Wai Koh, Tiem Leong Yoon, Thong Leng Lim +2

The structural and electronic properties of ternary AlxTiyNiz clusters, where x, y, and z are integers and x + y + z = 6 are investigated. Both SVWN and B3LYP exchange-correlation…

physics.atm-clus2018

The generation of ground state structures and electronic properties of ternary AlkTilNim clusters (k+l+m=4) from a two-stage DFT global searching approach

Pin Wai Koh, Tiem Leong Yoon, Thong Leng Lim +1

Structural and electronic properties of ternary clusters AlkTilNim, where k, l, and m are integers and k + l + m = 4 are investigated. These clusters are generated and studied by p…

Generation of ground state structures and electronic properties of ternary Alx​Tiy​Niz​ clusters (x+y+z=6) with a two-stage DFT global search approach

The generation of ground state structures and electronic properties of ternary AlkTilNim clusters (k+l+m=4) from a two-stage DFT global searching approach

Generation of ground state structures and electronic properties of ternary Al $_{x}$ Ti $_{y}$ Ni $_{z}$ clusters (x+y+z=6) with a two-stage DFT global search approach