Contains the keyword self-consistent-field
High-level theoretical study of the NO dimer and tetramer: Has the tetramer been observed? J Chem Phys. 2012;137:214316. Abstract
Diffusion of Atomic Oxygen on the Si(100) Surface. Journal of Physical Chemistry C. 2010;114:12649-58. Abstract
Water-Benzene Interactions: An Effective Fragment Potential and Correlated Quantum Chemistry Study. Journal of Physical Chemistry A. 2009;113:2092-102. Abstract
Binding and Diffusion of Al Adatoms and Dimers on the Si(100)-2 x 1 Reconstructed Surface: A Hybrid QM/MM Embedded Cluster Study. Journal of Physical Chemistry C. 2009;113:7277-89. Abstract
Accurate ab initio potential energy curve of F-2. III. The vibration rotation spectrum. J Chem Phys. 2007;127:204313. Abstract
















