scholarly journals Unusual hydroxyl migration in the fragmentation of β-alanine dication in the gas phase

2015 ◽  
Vol 17 (26) ◽  
pp. 16767-16778 ◽  
Author(s):  
Dariusz Grzegorz Piekarski ◽  
Rudy Delaunay ◽  
Sylvain Maclot ◽  
Lamri Adoui ◽  
Fernando Martín ◽  
...  
Keyword(s):  
Gas Phase ◽  
Theoretical Investigations ◽  
Fragmentation Dynamics

Experimental and theoretical investigations show that hydroxyl migration leads to unexpected fragmentation dynamics of β-alanine dication in the gas phase.

Experimental and theoretical investigations of the self-association of oxaliplatin

2014 ◽  
Vol 16 (28) ◽  
pp. 14688-14698 ◽  
Author(s):  
Predrag V. Petrović ◽  
Stefan Grimme ◽  
Snežana D. Zarić ◽  
Michel Pfeffer ◽  
Jean-Pierre Djukic
Keyword(s):  
Gas Phase ◽  
State Of The Art ◽  
The Self ◽  
Theoretical Investigations ◽  
Self Association ◽  
Self Aggregation

The issue of self-aggregation of oxaliplatin in water as well as in the gas phase is investigated analytically and analyzed by state-of-the-art DFT-D methods.

Optical Properties of a Visible Push–Pull Chromophore Covalently Bound to Carbohydrates: Solution and Gas-Phase Spectroscopy Combined to Theoretical Investigations

2012 ◽  
Vol 116 (2) ◽  
pp. 841-851 ◽  
Author(s):  
Quentin Enjalbert ◽  
Amandine Racaud ◽  
Jérôme Lemoine ◽  
Sébastien Redon ◽  
Mehmet Menaf Ayhan ◽  
...  
Keyword(s):  
Optical Properties ◽  
Gas Phase ◽  
Theoretical Investigations ◽  
Gas Phase Spectroscopy ◽  
Covalently Bound

Theoretical Investigations of the Reaction Dynamics of Gas-Phase HBr + Acetylene Collisions

1995 ◽  
Vol 99 (50) ◽  
pp. 17691-17699 ◽  
Author(s):  
Meredith E. Ebert ◽  
Samuel A. Abrash ◽  
Lionel M. Raff
Keyword(s):  
Gas Phase ◽  
Reaction Dynamics ◽  
Theoretical Investigations

Spectroscopic and theoretical investigations of adenosine 5′-diphosphate and adenosine 5′-triphosphate dianions in the gas phase

2013 ◽  
Vol 15 (18) ◽  
pp. 6640-6650 ◽  
Author(s):  
Florian Schinle ◽  
Paul E. Crider ◽  
Matthias Vonderach ◽  
Patrick Weis ◽  
Oliver Hampe ◽  
...  
Keyword(s):  
Gas Phase ◽  
Theoretical Investigations

Fragmentation dynamics of gas-phase furan followingK-shell ionization

2010 ◽  
Vol 82 (1) ◽  
Author(s):  
Z. D. Pešić ◽  
D. Rolles ◽  
I. Dumitriu ◽  
N. Berrah
Keyword(s):  
Gas Phase ◽  
Fragmentation Dynamics ◽  
Shell Ionization

Gas-phase infrared spectrum of phosphorus (III) oxycyanide, OPCN: experimental and theoretical investigations

1999 ◽  
Vol 478 (1-3) ◽  
pp. 193-197 ◽  
Author(s):  
Abdul.W. Allaf ◽  
M. Kassem ◽  
M. Alibrahim ◽  
Ihsan Boustani
Keyword(s):  
Infrared Spectrum ◽  
Gas Phase ◽  
Theoretical Investigations
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