Computational study of molecular properties with dual basis sets

由 Chwee, T.S., Lim, G.S., Fan, W.Y., Sullivan, M.B.
出版 2014

Spatial effect of C-H dipoles on the electron affinity of diamond (100)-2 x 1 adsorbed with organic molecules

由 Hui, Y.H., Kian, P.L., Sullivan, M.B., Wu, P.
出版 2014

First-principles study of silicon nanowire approaching the bulk limit

由 Ng, M.-F., Sullivan, M.B., Tong, S.W., Wu, P.
出版 2014

Electron transmission modes in electrically biased graphene nanoribbons and their effects on device performance

由 Shen, L., Zeng, M., Li, S., Sullivan, M.B., Feng, Y.P.
出版 2014

First-principles study of the thermoelectric properties of strained graphene nanoribbons

由 Yeo, P.S.E., Sullivan, M.B., Loh, K.P., Gan, C.K.
出版 2014

Towards understanding of laccase-catalysed oxidative oligomerisation of dimeric lignin model compounds

由 Ramalingam, B, Sana, B, Seayad, J, Ghadessy, F.J, Sullivan, M.B
出版 2020

Chemisorption-induced polarization of boron nitride nanotube

由 Zhang, J., Loh, K.P., Wu, P., Sullivan, M.B., Zheng, J.
出版 2014

Adsorption of molecular oxygen on the walls of pristine and carbon-doped (5,5) boron nitride nanotubes: Spin-polarized density functional study

由 Zhang, J., Loh, K.P., Zheng, J., Sullivan, M.B., Wu, P.
出版 2014

Oxidization states of metal atoms in linear bimetallic multi-sandwich molecules Vn(FeCp2)(n+1) and magnetic moment enhancement mechanism of its 1D wire

由 Shen, L., Jin, H., Ligatchev, V., Yang, S.-W., Sullivan, M.B., Feng, Y.
出版 2014

Aggregation dependent S1 and S2 dual emissions of thiophene-acrylonitrile- carbazole oligomer

由 Zhang, X., Loh, K.P., Sullivan, M.B., Chen, Z.-K., Liu, M.
出版 2014

Transparent conducting properties of SrSnO3 and ZnSnO3

由 Ong, K.P, Fan, X:, Subedi, A, Sullivan, M.B, Singh, D.J
出版 2020

Theoretical study on polyimide-Cu(100)/Ni(100) adhesion

由 Zhang, J., Sullivan, M.B., Zheng, J.W., Loh, K.P., Wu, P.
出版 2014

A HREELS and DFT study of the adsorption of aromatic hydrocarbons on diamond (111)

由 Hoh, H.Y., Ouyang, T., Sullivan, M.B., Wu, P., Nesladek, M., Loh, K.P.
出版 2014

Structural instability of epitaxial (001) BiFeO3 thin films under tensile strain

由 Fan, Z., Wang, J., Sullivan, M.B., Huan, A., Singh, D.J., Ong, K.P.
出版 2014

EPIC STAR: a reliable and efficient approach for phonon- and impurity-limited charge transport calculations

由 Deng, T., Wu, G., Sullivan, M.B., Wong, Z.M., Hippalgaonkar, K., Wang, J.-S., Yang, S.-W.
出版 2021

One-dimensional iron-cyclopentadienyl sandwich molecular wire with half metallic, negative differential resistance and high-spin filter efficiency properties

由 Zhou, L., Yang, S.-W., Ng, M.-F., Sullivan, M.B., Tan, V.B.C., Shen, L.
出版 2014

Computational and Experimental Investigation of the Structure of Peptide Monolayers on Gold Nanoparticles

由 Colangelo, E, Chen, Q, Davidson, A.M, Paramelle, D, Sullivan, M.B, Volk, M, Lévy, R
出版 2020

Band gap tunable N-type molecules for organic field effect transistors

由 Glowatzki, H., Sonar, P., Singh, S.P., Mak, A.M., Sullivan, M.B., Chen, W., Wee, A.T.S., Dodabalapur, A.
出版 2014

Step flow versus mosaic film growth in hexagonal boron nitride

由 Lu, J., Yeo, P.S.E., Zheng, Y., Xu, H., Gan, C.K., Sullivan, M.B., Castro Neto, A.H., Loh, K.P.
出版 2014

Building better lithium-sulfur batteries: From LiNO2 to solid oxide catalyst

由 Ding, N, Zhou, L, Zhou, C, Geng, D, Yang, J, Chien, S.W, Liu, Z, Ng, M.-F, Yu, A, Hor, T.S.A, Sullivan, M.B, Zong, Y
出版 2020