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Singlet-triplet interaction in Group 2 M2O hypermetallic oxides
(Academic Press Inc Elsevier Science, San Diego, 2014)
This ab initio study of Group 2 M2O hypermetallic oxides focuses mainly on the two heaviest members, Ba20 and Ra20. In accordance with previous studies in our group on the Be, Mg, Ca and Sr hypermetallic oxides, we find ...
Nonlinear frequency response analysis of forced periodic operation of non-isothermal CSTR using single input modulations. Part I: Modulation of inlet concentration or flow-rate
(Oxford : Pergamon-Elsevier Science Ltd, 2014)
Periodic operations of a non isothermal CSTR with n-Lh order reaction, subject to a single input modulation, is analysed using the nonlinear frequency response (NFR) method, introduced in our previous publications. The ...
Quantum mechanical and spectroscopic (FT-IR, C-13, H-1 NMR and UV) investigations of potent antiepileptic drug 1-(4-chloro-phenyl)-3-phenyl-succinimide
(Oxford : Pergamon-Elsevier Science Ltd, 2014)
This study represents an integrated approach towards understanding the vibrational, electronic, NMR, and structural aspects, and reactivity of 1-(4-chloro-phenyl)-3-phenyl-succinimide (CPPS). A detailed interpretation of ...
Synthesis and spectroscopic properties of large single-crystals of Pb(II), Hg(II) and Sr(II) methanesulfonato 1D coordination polymers
(Oxford : Pergamon-Elsevier Science Ltd, 2014)
Three new 1D coordination polymers, [Pb-2(CH3SO3)(4)(H2O)(2)](n), [Hg(CH3SO3)(2)(H2O)(2)](n) and [Sr(CH3SO3)(2)(H2O)](n), were synthesized as large single crystals. The crystals were analyzed and characterized by the means ...
Plasmonic sensors in multi-analyte environment: Rate constants and transient analysis
(Inst Chemical Engineers, Rugby, 2014)
This paper investigates multicomponent gas adsorption at the active surface of plasmonic chemical sensors and shows that there are situations where transients in a single sensor element can be used for simultaneous detection ...
Fluctuations of the number of adsorbed molecules due to adsorption–desorption processes coupled with mass transfer and surface diffusion in bio/chemical MEMS sensors
(Elsevier, 2014)
In this study we have developed, for the first time, the comprehensive theoretical model of the fluctuations of the number of adsorbed molecules in MEMS chemical and biological sensors, taking into account the processes ...