## page was renamed from Physical and Organic Chemistry K3/PhysChemLabRadiRight
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'''LABORATORY OF PHYSICAL CHEMISTRY'''----

Head of Laboratory: dr. Ingrid Milosev<<BR>> <<BR>>

'''Research programme'''

  * [[K3-en/PhysChemLabCorr|Electrochemical processes of passivation and corrosion on functional metal materials]]
  * [[K3-en/PhysChemLabWear|Wear of metal implants and related tissue reactions]]
  * Radical reactions and photo-dissociation of chemical species of atmospheric significance
  * [[K3-en/PhysChemLabSurf|Simulations of physico-chemical processes, such as simple catalytic reactions, at metal surfaces]]
  * [[K3-en/PhysChemLabGrap|Implementation of computer graphics aimed at scientific visualization]]----

'''Radical reactions and photo-dissociation of chemical species of atmospheric significance'''
Investigations of gas-phase elementary processes based on wave function and density functional methods are oriented to study molecules, radicals and reactions which play very important role in the chemistry related to tropospheric ozone production and stratospheric ozone loss. Emphasis is placed on the coupling reactions between NO,,x,,, ClO,,x,,, BrO,,x,,, and RO,,x,, radicals, and on the photodissociation pathways for the ground state and electronically excited state of the adducts/intermediates formed in particular radical-radical reactions. 

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  {{attachment:K3-en/PhysChemLab/radi_a.png}}
  {{attachment:K3-en/PhysChemLab/radi_b.png}}  <<BR>>


''(a) Minimum energy structures of Cl``NO,,3,, isomers and (b) schematic diagram of the potential energy surface for the Cl``O + NO,,2,, reaction calculated at the CBS-QB3 level''


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  {{attachment:K3-en/PhysChemLab/radi_c.png}} <<BR>>


''Dominant electronic transitions of Br``NO,,2,, and Cl``NO,,2,, (in red) isomers''