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Department of Chemistry and Department of Earth and Atmospheric Science
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top-articles
Department of Chemistry and Department of Earth and Atmospheric Science
41
(top 2%)
papers
699
(top 2%)
citations
15
(top 2%)
h
-index
26
(top 2%)
g
-index
43
all documents
722
doc citations
142
citing journals
Top Articles
#
Title
Journal
Year
Citations
1
Impact of Water on the OH + HOCl Reaction
Journal of the American Chemical Society
2011
92
2
Reactivity of Atmospherically Relevant Small Radicals at the Air–Water Interface
Angewandte Chemie - International Edition
2012
69
3
Reactivity of Volatile Organic Compounds at the Surface of a Water Droplet
Journal of the American Chemical Society
2012
65
4
Mechanistic Study of the Gas-Phase Decomposition of Methyl Formate
Journal of the American Chemical Society
2003
62
5
Stability of the cubic water octamer
Physical Review A
2003
44
6
Reactivity Trends within Alkoxy Radical Reactions Responsible for Chain Branching
Journal of the American Chemical Society
2011
32
7
A Computational Study of the Reaction of Methyl Formate with ·H and ·CH3Radicals
Journal of Physical Chemistry A
2002
30
8
The Origin of Sticking between a Hydroperoxy Radical and a Water Surface
Journal of the American Chemical Society
2004
28
9
Hydrogen bonding in cubic(H2O)8andOH∙(H2O)7clusters
Physical Review A
2005
23
10
Theoretical spectroscopic investigations of HNSq and HSNq (q = 0, +1, −1) in the gas phase
Journal of Chemical Physics
2014
23
11
An Experimental and Computational Study of the Kinetics and Mechanism of the Reaction of Methyl Formate with Cl Atoms
Journal of Physical Chemistry A
2000
21
12
Ab Initio Study of Key Branching Reactions in Biodiesel and Fischer–Tropsch Fuels
Journal of the American Chemical Society
2011
20
13
High level ab initio molecular orbital study of the structures and vibrational spectra of CH2Br and CH2Br+
Journal of Chemical Physics
1999
18
14
Structural and spectroscopic study of the van der Waals complex of CO with HCO+ and the isoelectronic complex of CS with HCS+
Journal of Chemical Physics
2012
18
15
Hydrogen Migrations in Alkylcycloalkyl Radicals: Implications for Chain‐Branching Reactions in Fuels
Chemistry - A European Journal
2012
17
16
Protonation of Water Clusters Induced by Hydroperoxyl Radical Surface Adsorption
Chemistry - A European Journal
2011
14
17
On the Mechanism of the BrO + CH2O Reaction
Journal of Physical Chemistry A
1999
12
18
Computational study of the linear proton bound ion–molecule complexes of HCNH+ with HCN and HNC
Journal of Chemical Physics
2013
12
19
Hydroxyalkoxy Radicals: Importance of Intramolecular Hydrogen Bonding on Chain Branching Reactions in the Combustion and Atmospheric Decomposition of Hydrocarbons
Journal of Physical Chemistry A
2014
12
20
A coupled-cluster study of the HOBr→HBrO transition state
Journal of Chemical Physics
1999
10
21
Explicitly correlated three-dimensional potential-energy surface of the thiazyl-hydride–helium weakly bound system and implications for HSN detection
Physical Review A
2016
10
22
Symmetry Breaking and the Molecular Structure of NO3+†
Journal of Physical Chemistry A
2001
8
23
Proton Affinity of Peroxyacetic Acid†
Journal of Physical Chemistry A
2004
8
24
Spectroscopic characterization of the five possible orientations of a hydrogen-bonded pair of water molecules within the cubic water octamer framework
Physical Review A
2005
8
25
Proton Affinity of Peroxyacetyl Nitrate (PAN)
Journal of Physical Chemistry A
2001
7
26
A complete active space self-consistent field multiconfiguration reference configuration interaction study of the potential energy curves of the ground and excited states of CCl
Journal of Chemical Physics
2001
6
27
Molecular boxes as storage containers forH2
Physical Review A
2004
5
28
Proton Affinity of Methyl Nitrite and Methyl Peroxynitrite: Implications for Measuring Branching Ratios of Alkyl Nitrates and Nitrites
Journal of the American Chemical Society
2008
5
29
Communication: Theoretical prediction of the structure and spectroscopic properties of the $\tilde{\mathrm{X}}$X̃ and $\tilde{\mathrm{A}}$Ã states of hydroxymethyl peroxy (HOCH2OO) radical
Journal of Chemical Physics
2013
5
30
Benchmark study of the structural and spectroscopic parameters of the hydroxymethyl peroxy (HOCH2OO) radical and its decomposition reaction to HO2 and H2CO
Journal of Chemical Physics
2017
5
31
Ab initio study of the electronic spectrum of peroxyacetyl nitrate
Journal of Chemical Physics
2004
4
32
Ab initio study of chain branching reactions involving second generation products in hydrocarboncombustion mechanisms
Physical Chemistry Chemical Physics
2012
4
33
Intramolecular hydrogen bonding in malonaldehyde and its radical analogues
Journal of Chemical Physics
2017
4
34
Hydrogen atom abstraction from HOOOCl by chlorine atom and OH radical
Inorganica Chimica Acta
2007
3
35
A coupled-cluster study of the mechanism for the CHF+H reaction
Journal of Chemical Physics
1999
2
36
CASSCF and MRCI studies on the electronic excited states of CHBrO, CClBrO, and CBr2O
Journal of Chemical Physics
2000
2
37
Stereoisomers of hydroxymethanes: Probing structural and spectroscopic features upon substitution
Journal of Chemical Physics
2016
2
38
Coupled Cluster and Second-Order Møller−Plesset Perturbation Studies of the Mechanism of the Gas-Phase Atom−Radical Reaction of Atomic Hydrogen with CF2 Radical
Journal of Physical Chemistry A
2000
1
39
Molecular structure, vibrational frequencies, energetics, and excited states of the HOONO+ ions
Journal of Chemical Physics
2003
1
40
Back Cover: Reactivity of Atmospherically Relevant Small Radicals at the Air-Water Interface (Angew. Chem. Int. Ed. 22/2012)
Angewandte Chemie - International Edition
2012
1
41
Spectroscopic characterization of the ethyl radical-water complex
Journal of Chemical Physics
2016
0
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