The Gas-Phase Hydrogen-Bonded Complex between Ozone and Hydroperoxyl Radical. A Theoretical Study

2007 ◽  
Vol 111 (5) ◽  
pp. 976-981 ◽  
Author(s):  
Alex Mansergas ◽  
Josep M. Anglada
Keyword(s):  
Gas Phase ◽  
Theoretical Study ◽  
Hydroperoxyl Radical ◽  
Hydrogen Bonded

Hydrogen-bonded clusters of hydroperoxyl radical with ammonia: a theoretical study

2010 ◽  
Vol 22 (1) ◽  
pp. 193-199 ◽  
Author(s):  
Mohammad Solimannejad ◽  
Farshideh Hasanvand Jamshidi ◽  
Saeid Amani
Keyword(s):  
Theoretical Study ◽  
Hydroperoxyl Radical ◽  
Hydrogen Bonded

Theoretical study of hydrogen bonding interactions in substituted nitroxide radicals

2021 ◽  
Author(s):  
Thufail M. Ismail ◽  
Neetha Mohan ◽  
P. K. Sajith
Keyword(s):  
Hydrogen Bonding ◽  
Interaction Energy ◽  
Electrostatic Potential ◽  
Molecular Electrostatic Potential ◽  
Theoretical Study ◽  
Nitroxide Radicals ◽  
Hydrogen Bonding Interactions ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Interaction energy (Eint) of hydrogen bonded complexes of nitroxide radicals can be assessed in terms of the deepest minimum of molecular electrostatic potential (Vmin).

Photoelectron Spectroscopy and Theoretical Study of AlnC5-/0 (n = 1-5) clusters: Structural Evolution, Relative Stability of Star-Like Cluster, and Planar Tetracoordinate Carbon Structure

2021 ◽  
Author(s):  
Chao-Jiang Zhang ◽  
Peng Wang ◽  
Xi-Ling Xu ◽  
Hong-Guang Xu ◽  
Weijun Zheng
Keyword(s):  
Gas Phase ◽  
Photoelectron Spectroscopy ◽  
Relative Stability ◽  
Theoretical Study ◽  
Structural Evolution ◽  
Carbon Structure ◽  
Anion Photoelectron Spectroscopy

The AlnC5- (n = 1-5) clusters were detected in the gas-phase and were investigated by mass-selected anion photoelectron spectroscopy. The structures of AlnC5-/0 (n = 1-5) were explored by theoretical...

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