화학공학소재연구정보센터
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No. Article
1 Interfacing the Ab Initio Multiple Spawning Method with Electronic Structure Methods in GAMESS: Photodecay of trans-Azonnethane
Gaenko A, DeFusco A, Varganov SA, Martinez TJ, Gordon MS
Journal of Physical Chemistry A, 118(46), 10902, 2014
2 Solvent-Induced Shifts in Electronic Spectra of Uracil
DeFusco A, Ivanic J, Schmidt MW, Gordon MS
Journal of Physical Chemistry A, 115(18), 4574, 2011
3 Solvent-Induced Frequency Shifts: Configuration Interaction Singles Combined with the Effective Fragment Potential Method
Arora P, Slipchenko LV, Webb SP, DeFusco A, Gordon MS
Journal of Physical Chemistry A, 114(25), 6742, 2010
4 Parallel tempering Monte Carlo simulations of the water heptamer anion
DeFusco A, Sommerfeld T, Jordan KD
Chemical Physics Letters, 455(4-6), 135, 2008
5 Model Potential Approaches for Describing the Interaction of Excess Electrons with Water Clusters: Incorporation of Long-Range Correlation Effects
Sommerfeld T, DeFusco A, Jordan KD
Journal of Physical Chemistry A, 112(44), 11021, 2008