TY  - JOUR
A1  - Kahn, S 
A1  - Zhang, O 
A1  - Broadbelt, L 
T1  - Automated mechanism generation. Part 1: mechanism development and rate constant estimation for VOC chemistry in the atmosphere
Y1  - 2009//01
N1  - R828169
JF  - JOURNAL OF ATMOSPHERIC CHEMISTRY
J1  - J ATMOS CHEM
VL  - 63
IS  - 2
SP  - 125
EP  - 156
ER  - 


TY  - JOUR
A1  - Kahn, S 
A1  - Broadbelt, L 
T1  - Automated mechanism generation. Part 2: application to atmospheric chemistry of alkanes and oxygenates
Y1  - 2009//01
N1  - R828169
JF  - JOURNAL OF ATMOSPHERIC CHEMISTRY
J1  - J ATMOS CHEM
VL  - 63
IS  - 2
SP  - 157
EP  - 186
ER  - 


TY  - JOUR
A1  - Khan, S S
A1  - Broadbelt, L J
T1  - A group additivity approach for the prediction of wavelength-dependent absorption cross-sections.
Y1  - 2004/03/
N1  - R828169
JF  - ATMOSPHERIC ENVIRONMENT
J1  - ATMOS ENVIRON
J2  - Atmos.Environ.
VL  - 38
IS  - 7
SP  - 1015
EP  - 1022
ER  - 


TY  - JOUR
A1  - Khan, S S
A1  - Yu, X 
A1  - Wade, J R
A1  - Malmgren, D 
A1  - Broadbelt, L J
T1  - Thermochemistry of radicals and molecules relevant to atmospheric chemistry: determination of group additivity values using G3//B3LYP theory.
Y1  - 2009/04/30
N1  - R828169
VL  - 113
IS  - 17
SP  - 5176
EP  - 5194
ER  - 


TY  - JOUR
A1  - Khan, S S
A1  - Zhang, Q 
A1  - Malmgren, D 
A1  - Broadbelt, L J
T1  - Automated mechanism generation. Part 1: Mechanism development and rate constant estimation for VOC chemistry in the atmosphere.
Y1  - 2009/06/
N1  - R828169
VL  - 63
IS  - 2
SP  - 125
EP  - 156
ER  - 


TY  - CONF
A1  - Broadbelt, L J
T1  - Construction of detailed mechanistic models using automated mechanism generation.
Y1  - 2002/04/11
N1  - R828169
ER  - 


TY  - CONF
A1  - Broadbelt, L J
A1  - Wong, H-S 
A1  - Zhang, Q 
A1  - Li, C 
A1  - Khan, S S
A1  - Hatzimanikatis, V 
T1  - Construction of detailed mechanistic models using automated mechanism generation
Y1  - 2003/04/3
N1  - R828169
ER  - 


TY  - CONF
A1  - Broadbelt, L J
A1  - Khan, S S
A1  - Zhang, Q 
T1  - Mechanistic modeling and rateconstant estimation of VOC chemistry in the atmosphere
Y1  - 2003/03/24
N1  - R828169
ER  - 


TY  - CONF
A1  - Broadbelt, L J
A1  - Wong, H-S 
A1  - Zhang, Q 
A1  - Li, C 
A1  - Khan, S S
A1  - Hatzimanikatis, V 
T1  - Construction of detailed mechanistic models using automated mechanism generation
Y1  - 2003/05/15
N1  - R828169
ER  - 


TY  - CONF
A1  - Broadbelt, L J
T1  - Computational methods for establishing reaction networks.
Y1  - 2003/10/13
N1  - R828169
ER  - 


TY  - CONF
A1  - Broadbelt, L J
T1  - Creating and harnessing complex reaction networks.
Y1  - 2003/10/28
N1  - R828169
ER  - 


TY  - CONF
A1  - Khan, S S
A1  - Zhang, Q 
A1  - Broadbelt, L J
T1  - Mechanistic modeling and rate constant estimation of VOC chemistry in the atmosphere.
Y1  - 2002/11/3-8
N1  - R828169
ER  - 


TY  - CONF
A1  - Khan, S S
A1  - Zhang, Q 
A1  - Malmgren, R D
A1  - Wade, J 
A1  - Broadbelt, L J
T1  - Engineering environmentally benign solvent systems: mechanistic models of ozone formation in the troposphere.
Y1  - 2003/11/16-21
N1  - R828169
ER  -