화학공학소재연구정보센터
검색결과 : 7건
No. Article
1 Metrics for Molecular Electronic Excitations: A Comparison between Orbital- and Density-Based Descriptors
Savarese M, Guido CA, Bremond E, Ciofini I, Adamo C
Journal of Physical Chemistry A, 121(40), 7543, 2017
2 An Ab Initio Description of the Excitonic Properties of LH2 and Their Temperature Dependence
Cupellini L, Jurinovich S, Campetella M, Caprasecca S, Guido CA, Kelly SM, Gardiner AT, Cogdell R, Mennucci B
Journal of Physical Chemistry B, 120(44), 11348, 2016
3 Plasmon Enhanced Light Harvesting: Multiscale Modeling of the FMO Protein Coupled with Gold Nanoparticles
Andreussi O, Caprasecca S, Cupellini L, Guarnetti-Prandi I, Guido CA, Jurinovich S, Viani L, Mennucci B
Journal of Physical Chemistry A, 119(21), 5197, 2015
4 A fully automated implementation of VPT2 Infrared intensities
Barone V, Bloino J, Guido CA, Lipparini F
Chemical Physics Letters, 496(1-3), 157, 2010
5 On the TD-DFT Accuracy in Determining Single and Double Bonds in Excited-State Structures of Organic Molecules
Guido CA, Jacquemin D, Adamo C, Mennucci B
Journal of Physical Chemistry A, 114(51), 13402, 2010
6 Structures and Properties of Electronically Excited Chromophores in Solution from the Polarizable Continuum Model Coupled to the Time-Dependent Density Functional Theory
Mennucci B, Cappelli C, Guido CA, Camlmi R, Tomasi J
Journal of Physical Chemistry A, 113(13), 3009, 2009
7 Calorimetric investigation of the aggregation of lithium perfluorooctanoate on poly(ethyleneglycol) oligomers in water
Gianni P, Bernazzani L, Guido CA, Mollica V
Thermochimica Acta, 451(1-2), 73, 2006