REPOZITORIU UPSC

Browsing Colecţia Instituţională by Subject "Proton transfer"

Browsing Colecţia Instituţională by Subject "Proton transfer"

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  • Originea Pseudo Jahn-Teller a barierei de energie a transferului de proton în dimerii protonați 
    BALAN, Iolanta; GORBACHEV, Mikhail; GORINCHOY, Natalia; ARSENE, Ion (Universitatea de Stat din Tiraspol, 2022)
    The Pseudo Jahn-Teller origin of the proton transfer energy barrier in MHM+ protonbound dimers is revealed by ab initio calculations of their electronic structures and energy curves of the adiabatic potential. The vibronic ...
  • Studiul energetic al transferului de protoni în molecula de uracil 
    ARSENE, Ion; PURCEL, Viorica (Universitatea Pedagogică de Stat "Ion Creangă", 2024)
    In this work, the possible mechanisms of proton migration in the process of tautomerization of the nitrogenous base uracil were studied. 3 possibilities for proton transfer initiation were identified and studied, with the ...

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