Sfoglia per ???browse.type.metadata.discipline??? Chimica e Geologia

Opzioni
Vai a: 0-9 A B C D E F G H I J K L M N O P Q R S T U V W X Y Z

Mostrati risultati da 881 a 900 di 1.944
Titolo Data di pubblicazione Autori Tipo File
INCLUSION OF HARTREE-FOCK EXCHANGE IN DENSITY-FUNCTIONAL METHODS - HYPERFINE-STRUCTURE OF 2ND ROW ATOMS AND HYDRIDES 1994 BARONE, Vincenzo 1.1 Articolo in rivista
INCLUSION OF HARTREE-FOCK EXCHANGE IN THE DENSITY-FUNCTIONAL APPROACH - BENCHMARK COMPUTATIONS FOR DIATOMIC-MOLECULES CONTAINING H, B, C, N, O, AND F ATOMS 1994 BARONE, Vincenzo 1.1 Articolo in rivista
Inexpensive and accurate predictions of optical excitations in transition-metal complexes: the TDDFT/PBE0 route 2000 BARONE, Vincenzo + 1.1 Articolo in rivista
Influence of base stacking on excited-state behavior of polyadenine in water, based on time-dependent density functional calculations 2007 BARONE, Vincenzo + 1.1 Articolo in rivista
The infrared and vibrational circular dichroism spectra of (S)proline in water: an ab initio study 2005 CAPPELLI, Chiara + 4.1 Contributo in Atti di convegno
Infrared Linear Dichroism in Stretched Films: Quantum Mechanical Approach Within the Polarizable Continuum Model 2005 CAPPELLI, Chiara + 1.1 Articolo in rivista
Infrared spectra, integrated band intensities, and anharmonic force field of H2C=CHF 2009 Tasinato, Nicola + 1.1 Articolo in rivista
The infrared spectrum of water. Basis set dependence at the single and double excitation coupled cluster (CCSD) level of theory 1988 Koch, Henrik + 1.1 Articolo in rivista
INHIBITION OF MUSHROOM TYROSINASE AND SOYBEAN LIPOXYGENASE BY REGIOLONE, A PHENOLIC COMPOUND FROM WALNUT HUSKS: A NEW POTENTIAL ADDITIVE FOR PREVENTION OF OXIDATIVE DETERIORATION OF FOOD 2015 M. d'Ischia + 4.2 Abstract in Atti di convegno
Inhibition of neuronal nitric oxide synthase by 6-nitrocatecholamines, putative reaction products of nitric oxide with catecholamines under oxidative stress conditions 2001 M. D'ISCHIA + 1.1 Articolo in rivista
Insights into structural and dynamical features of water at halloysite interfaces probed by DFT and classical molecular dynamics simulations 2016 MANCINI, GIORDANOBARONE, Vincenzo + 1.1 Articolo in rivista
Insights into the interaction between CH2F2 and titanium dioxide: DRIFT spectroscopy and DFT analysis of the adsorption energetics 2015 TASINATO, Nicola + 1.1 Articolo in rivista
Insights into the mechanism of action of plakortins, simple 1,2-dioxane antimalarials 2010 BARONE, Vincenzo + 1.1 Articolo in rivista
Integral direct calculation of CC2 excitation energies: singlet excited states of benzene 1996 Koch, Henrik + 1.1 Articolo in rivista
Integral-direct coupled cluster calculations of frequency-dependent polarizabilities, transition probabilities and excited-state properties 1998 CHRISTIANSEN, OveKoch, Henrik + 1.1 Articolo in rivista
The integral-direct coupled cluster singles and doubles model 1996 Koch, Henrik + 1.1 Articolo in rivista
Integrated Approach for Modeling the Emission Fluorescence of 4-(N,N-Dimethylamino)benzonitrile in Polar Environments 2008 BARONE, Vincenzo + 1.1 Articolo in rivista
Integrated computational approach to vibrationally resolved electronic spectra: anisole as a test case 2008 J. BloinoBARONE, Vincenzo + 1.1 Articolo in rivista
An integrated computational approach for the modeling of CW-ESR spectra of free radicals in solution 2006 BARONE, Vincenzo + 4.1 Contributo in Atti di convegno
Integrated computational approach to modelling physico-chemical processes of biological and technological relevance 2008 BARONE, Vincenzo 5.12 Altro
Mostrati risultati da 881 a 900 di 1.944
Legenda icone

  •  file ad accesso aperto
  •  file disponibili sulla rete interna
  •  file disponibili agli utenti autorizzati
  •  file non ad Accesso aperto
  •  file sotto embargo
  •  nessun file disponibile