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Elastic and Inelastic Response Spectra Considering Near-Fault Effects
(TAYLOR & FRANCIS LTD, 2011)
The differences in structural response to near-fault pulse-like, near-fault non pulse-like, and far-fault ground motions are examined based on elastic and inelastic response spectra. As a first step, the criteria to identify ...
Theoretical Studies of Solvent Effects in UV-vis Spectrum.
(Universidade Federal de PernambucoRecife, 2012-11-11)
Solvent effects are of essential importance in many different aspects of physics,
chemistry, biology and material sciences. The developments of quantum chemistry
methods originally devised for studying isolated molecules ...
DFT study of alpha-alanine as a function of the medium polarity
(Elsevier B.V., 2001-07-02)
The zwitterionic (Z) form, neutral (N) form and transition structure (TS) connecting N to Z, have been studied at the B3LYP/6-31++G** level of calculation by using the SCRF methodology. The intramolecular proton transfer ...
DFT study of alpha-alanine as a function of the medium polarity
(Elsevier B.V., 2001-07-02)
The zwitterionic (Z) form, neutral (N) form and transition structure (TS) connecting N to Z, have been studied at the B3LYP/6-31++G** level of calculation by using the SCRF methodology. The intramolecular proton transfer ...
Multifractal spectrum of quotients of Birkhoff averages for a family of quadratic maps
(Taylor & Francis, 2018-05)
In a recent article, Chung and Takahashi (Erg. Th & Dynan. Sys. 34, 1116 (2014)) effected a multifractal description of the Birkhoff spectrum for a set of quadratic one dimensional functions known as the Benedicks-Carleson ...
Theoretical and experimental study of the infrared spectrum of isonicotinamide
(Elsevier B.V., 2006-04-28)
The IR-spectrum of the isonicotinamide molecule (C(2)H(2)NC(3)H(2)CONH(2)) is studied by means of theoretical and experimental methods. For an appropriate representation of the molecular environment, Gaussian basis sets ...
Theoretical and experimental study of the infrared spectrum of isonicotinamide
(Elsevier B.V., 2006-04-28)
The IR-spectrum of the isonicotinamide molecule (C(2)H(2)NC(3)H(2)CONH(2)) is studied by means of theoretical and experimental methods. For an appropriate representation of the molecular environment, Gaussian basis sets ...