Ground state structures and photoelectron spectroscopy of [Com(coronene)]− complexes
نویسندگان
چکیده
منابع مشابه
Ground state structures and photoelectron spectroscopy of [Com(coronene)]- complexes.
A synergistic approach involving theory and experiment has been used to study the structure and properties of neutral and negatively charged cobalt-coronene [Com(coronene)] complexes. The calculations are based on density functional theory with generalized gradient approximation for exchange and correlation potential, while the experiments are carried out using photoelectron spectroscopy of mas...
متن کاملTheoretical and Experimental Photoelectron Spectroscopy Characterization of the Ground State of Thymine Cation.
We report on the vibronic structure of the ground state X̃(2)A″ of the thymine cation, which has been measured using a threshold photoelectron photoion coincidence technique and vacuum ultraviolet synchrotron radiation. The threshold photoelectron spectrum, recorded over ∼0.7 eV above the ionization potential (i.e., covering the whole ground state of the cation) shows rich vibrational structure ...
متن کاملCharacterization of the I2 2 anion ground state using conventional and femtosecond photoelectron spectroscopy
The X̃ Su 1 state of the I2 2 anion has been fit to a Morse potential using data from two techniques: conventional and femtosecond photoelectron spectroscopy ~FPES!. Conventional photoelectron spectroscopy is used to determine the adiabatic electron affinity of I2 as well as the well depth and equilibrium nuclear geometry of I2 . In the FPES experiment, the pump pulse induces coherent nuclear mo...
متن کاملPhotoelectron imaging spectroscopy of Cu (H2O)1,2 anion complexes
We report high resolution photoelectron imaging spectra of Cu and Cu (H2O)n (n = 1,2) complexes. With the least bound electron principally localized on the metal, electron photodetachment produces neutral states that are best characterized by the atomic metal state plus a water molecule: [Cu (S), H2O], [Cu ( D5/2), H2O], and [Cu ( D3/2), H2O]. The large Cu –H2O separation gives rise to a remark...
متن کاملAnion Photoelectron Spectroscopy of Solvated Transition State Precursors
Photoelectron ~PE! spectra have been collected for the clustered bihalide anions XHX•~M! ~X5Br, I! and BrHI•~M!, where M5H2O, HBr, and HI, in order to probe the effects of strongly solvating species on the PE spectra of transition state precursor anions. The PE spectra of the XHX•~H2O) ions show similar vibrational progressions as the spectra of the bare BrHBr and IHI anions, indicating that ph...
متن کاملذخیره در منابع من
با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید
ژورنال
عنوان ژورنال: The Journal of Chemical Physics
سال: 2007
ISSN: 0021-9606,1089-7690
DOI: 10.1063/1.2437202