publication venue for
- Chapter 4 Analysis of programmable molecular electronic systems. 17:96-140. 2007
- Chapter 1 Electrical characteristics of bulk-molecule interfaces. 18:1-33. 2007
- Chapter 6 Hydrogen adsorption in corannulene-based materials. 18:127-166. 2007
- Advances in many-body valence-bond theory. 6:403-421. 1999
- Chapter 11 Ab initio and molecular dynamics studies of cationwater interactions. 7:431-469. 1999
- Chapter 6 Ab initio and DFT for the strength of classical molecular dynamics. 7:187-229. 1999
- Inter-relations between VB & MO theories for organic II-networks. 5:33-50. 1998
- DFT Study of Nickel: Towards the MD Simulation of the Nickel-Water Interface. 4:649-677. 1996
- Density Functional Calculations of Heats of Reaction. 4:811-824. 1996
- An introduction to density functional theory in chemistry. 2:1-27. 1995
- Density functional studies of decomposition processes of energetic molecules. 2:371-382. 1995
- Density functional theory: Further applications. 2:383-401. 1995
- Electrical Characteristics of Bulk-Molecule Interfaces 2007
- Hydrogen Adsorption in Corannulene-based Materials 2007
- Metal-molecule-semiconductor junctions: An ab initio analysis 2007
- Molecular and Nano Electronics: Analysis, Design and Simulation Preface 2007
- Nanomaterials: Design and Simulation Preface 2007
- Chapter 1 Metalmoleculesemiconductor junctions:An ab initio analysis 2007
- Preface 2007
- Preface 2007
- Preface 1999