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TITLE: Hybrid Quantum/Classical Simulations of the Vibrational Relaxation of the Amide I Mode of N-Methylacetamide in D2O Solution
AUTHORS: Adolfo Bastida; Miguel A Soler; Jose Zuniga; Alberto Requena; Adrian Kalstein; Sebastian Fernandez Alberti;
PUBLISHED: 2012, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 116, ISSUE: 9
INDEXED IN: Scopus WOS CrossRef
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TITLE: Analysis of State-Specific Vibrations Coupled to the Unidirectional Energy Transfer in Conjugated Dendrimers
AUTHORS: Miguel A Soler; Adrian E Roitberg; Tammie Neson; Sergei Tretiak; Sebastian Fernandez Alberti;
PUBLISHED: 2012, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY A, VOLUME: 116, ISSUE: 40
INDEXED IN: Scopus WOS CrossRef
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TITLE: Vibrational dynamics of polyatomic molecules in solution: assignment, time evolution and mixing of instantaneous normal modes  Full Text
AUTHORS: Adrian Kalstein; Sebastian Fernandez Alberti; Adolfo Bastida; Miguel A Angel Soler; Marwa H Farag; Jose Zuniga; Alberto Requena;
PUBLISHED: 2011, SOURCE: THEORETICAL CHEMISTRY ACCOUNTS, VOLUME: 128, ISSUE: 4-6
INDEXED IN: Scopus WOS CrossRef
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TITLE: Instantaneous normal modes, resonances, and decay channels in the vibrational relaxation of the amide I mode of N-methylacetamide-D in liquid deuterated water  Full Text
AUTHORS: Adolfo Bastida; Miguel A Angel Soler; Jose Zuniga; Alberto Requena; Adrian Kalstein; Sebastian Fernandez Alberti;
PUBLISHED: 2010, SOURCE: JOURNAL OF CHEMICAL PHYSICS, VOLUME: 132, ISSUE: 22
INDEXED IN: Scopus WOS CrossRef
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TITLE: Molecular Dynamics Simulations and Instantaneous Normal-Mode Analysis of the Vibrational Relaxation of the C-H Stretching Modes of N-methylacetamide-d in Liquid Deuterated Water
AUTHORS: Adolfo Bastida; Miguel A Soler; Jose Zuniga; Alberto Requena; Adrian Kalstein; Sebastian Fernandez Alberti;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY A, VOLUME: 114, ISSUE: 43
INDEXED IN: Scopus WOS CrossRef