Structure and dynamics of molecules in high charge states
D Mathur - Physics reports, 2004 - Elsevier
The last decade has seen very substantial progress in the understanding of the formation
and decay dynamics of multiply charged molecules, their structure, and their interactions …
and decay dynamics of multiply charged molecules, their structure, and their interactions …
1, 2-Dications in organic main group systems
VG Nenajdenko, NE Shevchenko… - Chemical …, 2003 - ACS Publications
Investigations of reactive intermediates that possess high energies and unusual reactivities
comprise one of the most fascinating topics of today's chemistry. Such studies push the limits …
comprise one of the most fascinating topics of today's chemistry. Such studies push the limits …
Investigating the gas-phase chemical reactions of molecular dications
SD Price - Physical Chemistry Chemical Physics, 2003 - pubs.rsc.org
In the gas phase, the doubly-charged ions of small molecules (molecular dications) exhibit a
wide range of reactivity following bimolecular collisions with neutral species. This feature …
wide range of reactivity following bimolecular collisions with neutral species. This feature …
Spectroscopy and metastability of CO22+ molecular ions
The spectroscopy and metastability of the carbon dioxide doubly charged ion, the CO 2 2+
dication, have been studied with photoionization experiments: time-of-flight photoelectron …
dication, have been studied with photoionization experiments: time-of-flight photoelectron …
Interactions of molecular doubly charged ions with atoms, molecules and photons
SD Price - Journal of the Chemical Society, Faraday Transactions, 1997 - pubs.rsc.org
Gas-phase molecular dipositive ions (molecular dications) are highly unusual and reactive
species. The majority of dicationic electronic states rapidly fragment to form a pair of singly …
species. The majority of dicationic electronic states rapidly fragment to form a pair of singly …
Photo double ionization spectra of CO: comparison of theory with experiment
JHD Eland, M Hochlaf, GC King… - Journal of Physics B …, 2004 - iopscience.iop.org
High level ab initio calculations have been undertaken of potential energy curves of CO
2+(and for the CO neutral ground state). The accuracy of the potentials was tested by a …
2+(and for the CO neutral ground state). The accuracy of the potentials was tested by a …
Interaction components in the hydrogen halide dications
We have theoretically investigated the interatomic interaction in the low-lying states of HX2+
dications (X= F, Cl, Br, I) by combining results from semiempirical method with ab initio …
dications (X= F, Cl, Br, I) by combining results from semiempirical method with ab initio …
Computed lifetimes of metastable states of CO2+
T Šedivcová, PR Žďánská, V Špirko… - The Journal of chemical …, 2006 - pubs.aip.org
Highly correlated internally contracted multireference configuration interaction wave
functions are used to calculate the potential energy and spin-orbit coupling functions for the …
functions are used to calculate the potential energy and spin-orbit coupling functions for the …
The double photoionization of HCl: an ion–electron coincidence study
The double photoionization of HCl molecules by synchrotron radiation has been studied in
the energy range between 30 and 50 eV. The HCl 2+ and Cl 2+ product ions have been …
the energy range between 30 and 50 eV. The HCl 2+ and Cl 2+ product ions have been …
Predicted structure and energetics of HCl2+
The potential energy in the low-lying electronic states of the HCl2+ molecular dication has
been investigated through an empirical method, founded on the identification and …
been investigated through an empirical method, founded on the identification and …