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Albert DeFusco
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Modeling solvent effects on electronic excited states
A DeFusco, N Minezawa, LV Slipchenko, F Zahariev, MS Gordon
The Journal of Physical Chemistry Letters 2 (17), 2184-2192, 2011
1332011
Solvent-induced frequency shifts: configuration interaction singles combined with the effective fragment potential method
P Arora, LV Slipchenko, SP Webb, A DeFusco, MS Gordon
The Journal of Physical Chemistry A 114 (25), 6742-6750, 2010
822010
Model potential approaches for describing the interaction of excess electrons with water clusters: Incorporation of long-range correlation effects
T Sommerfeld, A DeFusco, KD Jordan
The Journal of Physical Chemistry A 112 (44), 11021-11035, 2008
762008
Direct measurement of the energy thresholds to conformational isomerization in Tryptamine: Experiment and theory
JR Clarkson, BC Dian, L Moriggi, A DeFusco, V McCarthy, KD Jordan, ...
The Journal of chemical physics 122 (21), 2005
722005
Solvent-induced shifts in electronic spectra of uracil
A DeFusco, J Ivanic, MW Schmidt, MS Gordon
The Journal of Physical Chemistry A 115 (18), 4574-4582, 2011
662011
Comparison of models with distributed polarizable sites for describing water clusters
A Defusco, DP Schofield, KD Jordan
Molecular Physics 105 (19-22), 2681-2696, 2007
612007
Low-lying isomers and finite temperature behavior of (H2O) 6−
T Sommerfeld, SD Gardner, A DeFusco, KD Jordan
The Journal of chemical physics 125 (17), 2006
532006
Interfacing the Ab Initio Multiple Spawning Method with Electronic Structure Methods in GAMESS: Photodecay of trans-Azomethane
A Gaenko, A DeFusco, SA Varganov, TJ Martínez, MS Gordon
The Journal of Physical Chemistry A 118 (46), 10902-10908, 2014
362014
Parallel tempering Monte Carlo simulations of the water heptamer anion
A DeFusco, T Sommerfeld, KD Jordan
Chemical Physics Letters 455 (4-6), 135-138, 2008
232008
Displacement‐cyclization reactions of mono‐substituted hydrazines with chloronitrobenzenes and chloronitropyrimidines. New routes to 8‐azapurine and benzopyrazole derivatives
AA Defusco, MJ Strauss
Journal of Heterocyclic Chemistry 18 (2), 351-355, 1981
91981
Математическое моделирование систем защиты данных на основе диофантовых уравнений
ВО Осипян
Прикаспийский журнал: управление и высокие технологии, 152-160, 2018
72018
Systems analysis of the effects of the 2014-16 Ebola crisis on WHO-reporting nations’ policy adaptations and 2020-21 COVID-19 response: a systematized review
J Hanson-DeFusco, M Shi, Z Du, O Zounon, FM Hounnouvi, A DeFusco
Globalization and Health 19 (1), 96, 2023
2023
CIM-CC benchmarks of the first hyperpolarizabilities of extended NLO molecules
A DeFusco, MS Gordon
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 241, 2011
2011
A paper submitted to the Journal of Physical Chemistry
P Arora, LV Slipchenko, SP Webb, A DeFusco, MS Gordon
Development and application of QM/MM methods to study the solvation effects …, 2010
2010
Vertical excitations of nucleobases in solution
AA DeFusco III, J Ivanic, MW Schmidt, MS Gordon
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 238, 2009
2009
Many body interactions of neutral and charged hydrogen bonded clusters
AA DeFusco III
University of Pittsburgh, 2008
2008
PHYS 572-Electron attachment to large water clusters
AA DeFusco III, T Sommerfeld, KD Jordan
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 234, 2007
2007
Many body interactions of small water clusters
AA DeFusco III, J Cui, KD Jordan
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 234, 2007
2007
Electron binding motifs of water cluster anions, and how to model this class of systems
T Sommerfeld, AA DeFusco III, KD Jordan
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 234, 2007
2007
PHYS 462-Role of polarization in simulations of methane hydrate
DP Schofield, H Jiang, AA DeFusco III, KD Jordan
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 232, 2006
2006
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