Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Tonachini, A."'
Autor:
Andrea, Cernuto, Allan, Lopes, Claire, Romanzin, Barbara, Cunha de Miranda, Daniela, Ascenzi, Paolo, Tosi, Glauco, Tonachini, Andrea, Maranzana, Miroslav, Polášek, Jan, Žabka, Christian, Alcaraz
Publikováno v:
The Journal of chemical physics. 147(15)
The methyl carbocation is ubiquitous in gaseous environments, such as planetary ionospheres, cometary comae, and the interstellar medium, as well as combustion systems and plasma setups for technological applications. Here we report on a joint experi
Autor:
Paolo Tosi, Andrea Maranzana, Miroslav Polášek, Daniela Ascenzi, Claire Romanzin, Christian Alcaraz, Barbara Cunha de Miranda, Glauco Tonachini, Ján Žabka, Allan Lopes, Andrea Cernuto
Publikováno v:
Journal of Chemical Physics
Journal of Chemical Physics, American Institute of Physics, 2017, 147 (15), pp.154302. ⟨10.1063/1.4990514⟩
Journal of Chemical Physics, American Institute of Physics, 2017, 147 (15), pp.154302. ⟨10.1063/1.4990514⟩
The methyl carbocation is ubiquitous in gaseous environments, such as planetary ionospheres, cometary comae, and the interstellar medium, as well as combustion systems and plasma setups for technological applications. Here we report on a joint experi
Publikováno v:
The Journal of Chemical Physics. 118:10575-10583
Alkyl peroxyls form in the atmospheric oxidation of hydrocarbons and in their combustion. When NO concentration is low, they can appreciably react with themselves. This reaction has both propagation and termination channels. Multireference second-ord
Publikováno v:
The Journal of chemical physics. 133(18)
The reactivity of naphthyl cations with benzene is investigated in a joint experimental and theoretical approach. Experiments are performed by using guided ion beam tandem mass spectrometers equipped with electron impact or atmospheric pressure chemi
Publikováno v:
The Journal of Chemical Physics. 138:204310
The reactivity of biphenylium cations C12H9(+) with benzene C6H6 is investigated in a joint experimental and theoretical approach. Experiments are performed by using a triple quadruple mass spectrometer equipped with an atmospheric pressure chemical
Autor:
H. Bernhard Schlegel, Glauco Tonachini
Publikováno v:
The Journal of Chemical Physics. 87:514-519
The Rys polynomial method has been used to evaluate the first derivatives of the two electron integrals and the nuclear electron attraction integrals with respect to the Gaussian exponents. Gradients for the sulfur 6‐31 G(d) basis set in HS−, H2S