To date, SMA Fellows have published 366 articles in 289 journals while 51 articles have been accepted for publication in 43 journals. Some articles are listed under more than one category.

Digital Materials Design

Journal Publications

1. Lee B. K., Jin H. M & Wu P., “Theoretical Estimation of Coefficient of Thermal Expansion for Solder Alloy”, Journal of Materials Science, Vol. 38, pp. 1135-1137 (2003).
   
   
2. Yang S. W., Zhang H., Wu P. & Loh K. P., “Chemisorption of C2 Biradical and Acetylene on Reconstructed Diamond(111)-(2 x 1)”, Journal of Physics Chemical B, Vol. 107, pp. 985-993 (2003).
   
   
3. Li C. H. & Wu P., “Empirical Relation of Melting Temperatures of CsCltype Intermetallic Compounds to their Cohesive Energies”, Chemistry of Materials, Vol. 14 (11), pp. 4833-4836 (2002).
   
   
4. Yang S. W., Zhang H., Lim C. W., Soon J. M., Zheng J. C., Wu P. & Loh K. P., “Ab Initio Studies of Borazine and Benzene Cyclacenes”, Diamond & Related Materials, Vol. 12 (3-7), pp. 1194-1200 (2003).
   
   
5. Zeng Y. Z., Chua S. J. & Wu P., “On the Prediction of Ternary Semiconductor Properties by Artificial Intelligence Methods”, Chemistry of Materials, Vol.14 (7), pp. 2989-2998 (2002).
   
   
6. Bai K. W. & Wu P., “Assessment of the Zn-Fe-Al System for Kinetic Study of Galvanizing”, Journal of Alloys and Compound, Vol. 347 (1-2), pp. 156-164 (2002).
   
   
7. Li C. H., Lim S. H. & Wu P., “Melting Point Prediction Model for Binary Laves Phase”, Journal of Physics and Chemistry of Solids, Vol. 64, pp.201-212 (2003).
   
   
8. Loh K. P., Xie X. N., Yang S. W. & Wu P., “A Spectroscopic Study of the Negative Electron Affinity of Cesium-Oxide Coated Diamond (111) and Theoretical Calculation of the Surface Density-of-States on Oxygenated Diamond (111)”, Diamond & Related Materials, Vol. 11, pp. 1379 (2002).
   
   
9. Wu P., Jin H. M. & Liu H. L., “Investigation of Additive Effects on Zn Diffusion in Hot-Dip Galvanizing by DFT Calculations”, Chemistry of Materials, Vol. 14, pp. 832-837 (2002).
   
   
10. Zhu W. H., Jin H. M., Wu P. & Liu H. L., “Periodic Density Functional Theory Study of the Crystal Morphology of FeZn13 “, Physical Review B, Vol. 70, pp.165419 (2004).
    
    
11. Zhu W. H., Jin H. M., Wu P. & Liu H. L., “The Effects of Additives Ag and Ni on Zn Diffusion in Steel Hot-Dip Galvanizing: An ab initio Molecular Dynamics Simulation”, Chemistry of Materials, Vol. 16 (26), pp. 5567-5573 (2004).
    
    
12. Zhu W. H. & Wu P., “Surface Energetics of Hydroxyapatite: A DFT study”, Chemical Physics Letters, Vol. 396 (1-3), pp. 38-42 (2004).
    
    
13. Yu Z. G., Gong H. & Wu P., “Dopant Sources Choice for Formation of p-type ZnO: The Case of Phosphorus Compound Sources”, Chemistry of Materials, Vol. 17 (4), pp. 852-855 (2005).
    
    
14. Lin G. Q., Gong H. & Wu P., “Electronic Properties of Barium Chalcogenides from First-Principles Calculations, a New Class of II-VI Semiconductors”, Physical Review B, Vol. 71, pp. 085203 (2005).
    
    
15. Mao P. L., Liu T. F., Kueh K. & Wu P., “Predicting the Efficiency of UAG Translational Stop Signal through Studies of Physicochemical Properties of its Composite Mono- and Dinucleotides”, Computational Biology and Chemistry, Vol. 28 (4), pp. 245-256 (2004).

Conference Publications

1. Wu P., Lin G. Q. & Zeng Y. Z., “Property Prediction of New Semiconductors by Computer Modeling and Simulation”, Proceedings of SPIE’s International Symposium on Smart Materials, Nano-, and Micro-Smart Systems, Vol. 4934, pp. 258-269, Melbourne, Australia, 16-18 December 2002.
   
   
2. Bai K. W. & Wu P., “Prediction of New Lead-Free Alloys for “Drop-in” Replacement of the Sn-Pb Solders”, Proceedings of Calphd XXXII, La Malbaie, Quebec, Canada, 25-30 May 2003.