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Michele Pavone

Showing results (21-30 of 153) with videos related to

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Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|December 7, 2005
Spectroscopic properties in the liquid phase: combining high-level ab initio calculations and classical molecular dynamicsMichele Pavone, Giuseppe Brancato, Giovanni Morelli, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|November 5, 2011
Accurate bond energies of hydrocarbons from complete basis set extrapolated multi-reference singles and doubles configuration interactionVictor B Oyeyemi, Michele Pavone, Emily A Carter
Biomedicines|April 23, 2022
Molecular Mechanisms in Lysosomal Storage Diseases: From Pathogenesis to Therapeutic StrategiesValeria De Pasquale, Melania Scarcella, Luigi Michele Pavone
Journal of Chemical Theory and Computation|December 2, 2015
Accurate First-Principle Prediction of (29)Si and (17)O NMR Parameters in SiO2 Polymorphs: The Cases of Zeolites Sigma-2 and FerrieriteAlfonso Pedone, Michele Pavone, Maria Cristina Menziani, et al.
The Journal of Physical Chemistry. B|July 21, 2006
Solvent effects on the UV (n --> pi*) and NMR (13C and 17O) spectra of acetone in aqueous solution. An integrated car-parrinello and DFT/PCM approachOrlando Crescenzi, Michele Pavone, Filippo De Angelis, et al.
Journal of the American Chemical Society|March 30, 2006
Interplay of stereoelectronic and enviromental effects in tuning the structural and magnetic properties of a prototypical spin probe: further insights from a first principle dynamical approachMichele Pavone, Paola Cimino, Filippo De Angelis, et al.
Materials (Basel, Switzerland)|August 26, 2022
First-Principles Study of Cu-Based Inorganic Hole Transport Materials for Solar Cell ApplicationsAdriana Pecoraro, Pasqualino Maddalena, Michele Pavone, et al.
European Urology|March 24, 2004
Handling and pathology reporting of specimens with carcinoma of the urinary bladder, ureter, and renal pelvisAntonio Lopez-Beltran, PierFrancesco Bassi, Michele Pavone-Macaluso, et al.
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|November 12, 2025
Electronic Structure and Interfacial Hole Transfer in a Di-Rhodium Photocatalyst on a p‑Type NiO ElectrodeFrancesca Fasulo, Adriana Pecoraro, Ana B Muñoz-García, et al.
The Journal of Physical Chemistry. A|July 27, 2012
Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicalsTing Tan, Michele Pavone, David B Krisiloff, et al.
Pageof 16

Showing results (21-30 of 153) with videos related to

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Pageof 16
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|December 7, 2005
Spectroscopic properties in the liquid phase: combining high-level ab initio calculations and classical molecular dynamicsMichele Pavone, Giuseppe Brancato, Giovanni Morelli, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|November 5, 2011
Accurate bond energies of hydrocarbons from complete basis set extrapolated multi-reference singles and doubles configuration interactionVictor B Oyeyemi, Michele Pavone, Emily A Carter
Biomedicines|April 23, 2022
Molecular Mechanisms in Lysosomal Storage Diseases: From Pathogenesis to Therapeutic StrategiesValeria De Pasquale, Melania Scarcella, Luigi Michele Pavone
Journal of Chemical Theory and Computation|December 2, 2015
Accurate First-Principle Prediction of (29)Si and (17)O NMR Parameters in SiO2 Polymorphs: The Cases of Zeolites Sigma-2 and FerrieriteAlfonso Pedone, Michele Pavone, Maria Cristina Menziani, et al.
The Journal of Physical Chemistry. B|July 21, 2006
Solvent effects on the UV (n --> pi*) and NMR (13C and 17O) spectra of acetone in aqueous solution. An integrated car-parrinello and DFT/PCM approachOrlando Crescenzi, Michele Pavone, Filippo De Angelis, et al.
Journal of the American Chemical Society|March 30, 2006
Interplay of stereoelectronic and enviromental effects in tuning the structural and magnetic properties of a prototypical spin probe: further insights from a first principle dynamical approachMichele Pavone, Paola Cimino, Filippo De Angelis, et al.
Materials (Basel, Switzerland)|August 26, 2022
First-Principles Study of Cu-Based Inorganic Hole Transport Materials for Solar Cell ApplicationsAdriana Pecoraro, Pasqualino Maddalena, Michele Pavone, et al.
European Urology|March 24, 2004
Handling and pathology reporting of specimens with carcinoma of the urinary bladder, ureter, and renal pelvisAntonio Lopez-Beltran, PierFrancesco Bassi, Michele Pavone-Macaluso, et al.
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|November 12, 2025
Electronic Structure and Interfacial Hole Transfer in a Di-Rhodium Photocatalyst on a p‑Type NiO ElectrodeFrancesca Fasulo, Adriana Pecoraro, Ana B Muñoz-García, et al.
The Journal of Physical Chemistry. A|July 27, 2012
Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicalsTing Tan, Michele Pavone, David B Krisiloff, et al.
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