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Applications of the Schwinger Multichannel Method with pseudopotentials to electron scattering from polyatomic molecules II. Rotational excitation cross sections
(Sociedade Brasileira FisicaSao PauloBrasil, 2001)
Thermal effects on the electric deflection of toluene molecules
(Elsevier Science, 2008-12)
A series of precise electric deflection experiments were done on a supersonic beam of toluene molecules in several expansion conditions and field strengths. We analyzed the effect of a gradual rotational cooling on the ...
Valence fluctuations in a lattice of magnetic molecules: Application to iron(II) phtalocyanine molecules on Au(111)
(Europhysics Letters, 2015-02)
We study theoretically a square lattice of the organometallic Kondo adsorbate iron(II) phtalocyanine (FePc) deposited on top of Au(111), motivated by recent scanning tunneling microscopy experiments. We describe the system ...
Classical mechanics of dipolar asymmetric top molecules in collinear static electric and nonresonant linearly polarized laser fields: energy-momentum diagrams, bifurcations and accessible configuration space
(World Scientific Publishing, 2008-02-08)
We study classical energy-momentum ($E$-$m$) diagrams for rotational motion of dipolar asymmetric top molecules in strong external fields. Static electric fields, nonresonant linearly polarized laser fields, and collinear ...
Clonación del gen crtI, procedente de Rhodotorula mucilaginosa EA-BIO010 en cepas de Escherichia coli TOP10, mediante técnicas de ingeniería genética
(Universidad EAFITBiologíaEscuela de Ciencias Aplicadas e Ingeniería. Departamento de Ciencias BiológicasMedellín, 2023)
Reactive oxygen species are unstable molecules that contain oxygen and react easily with other molecules in the cell where they cause damage to lipid molecules, proteins and DNA. To combat them, antioxidants such as ...
Performance of the LRESC Model on top of DFT Functionals for Relativistic NMR Shielding Calculations
(American Chemical Society, 2020-02)
The linear response within the elimination of the small component model (LRESC) is an insightful and computationally efficient method for including relativistic effects on molecular properties like the nuclear magnetic ...
Além da atividade proteolítica das metaloproteases: atividade imunomoduladora da Thimet oligopeptidase (TOP) no tratamento do melanoma murino B16F10Nex2
(Universidade Federal de São Paulo (UNIFESP), 2017-02-28)
Previous studies in our laboratory have shown that two bacterial metalloproteases, oligopeptidase A (OpdA) and arazyme, have antitumor activity. This property was independent of their proteolytic activity, and it was ...
Seletividade de sistemas de controle químico de plantas daninhas na cultura do algodoeiroSelectivity of weed chemical control system in cotton (Gossypium hirsutum L.)
(Universidade Estadual de MaringáBrasilUEMMaringá, PRPrograma de Pós-Graduação em Agronomia, 2018)
Exploring the electron density localization in single MoS2 monolayers by means of a localize-electrons detector and the quantum theory of atoms in molecules
(2017)
The nature of the electron density localization in a MoS2 monolayer under 0 % to 11% tensile strain has been systematically studied by means of a localized electron detector function and the Quantum Theory of atoms in ...