Rate constants for H abstraction from benzo(a)pyrene and chrysene: a theoretical study

Modeling study of combustion and pollutant formation in HCCI engine operating on hydrogen rich fuel blends

(2016) V.E. Kozlov et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Validation of turbulent flame speed models for methane–air-mixtures at high pressure gas engine conditions

(2015) Ansgar Ratzke et al.   COMBUSTION AND FLAME

Active Thermochemical Tables: Sequential Bond Dissociation Enthalpies of Methane, Ethane, and Methanol and the Related Thermochemistry

(2015) Branko Ruscic   JOURNAL OF PHYSICAL CHEMISTRY A

Combustion kinetic model uncertainty quantification, propagation and minimization

(2015) Hai Wang et al.   PROGRESS IN ENERGY AND COMBUSTION SCIENCE

Bioaccumulation and oxidative damage in juvenile scallop Chlamys farreri exposed to benzo[a]pyrene, benzo[b]fluoranthene and chrysene

(2014) Meng Xiu et al.   ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY

Reaction mechanism for the free-edge oxidation of soot by O2

(2012) Abhijeet Raj et al.   COMBUSTION AND FLAME

A reaction mechanism for gasoline surrogate fuels for large polycyclic aromatic hydrocarbons

(2011) Abhijeet Raj et al.   COMBUSTION AND FLAME

Bioaccumulation of phenanthrene and benzo[a]pyrene in Calanus finmarchicus

(2011) Louise Kiel Jensen et al.   ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY

A mechanistic study on the simultaneous elimination of soot and nitric oxide from engine exhaust

(2010) Abhijeet Raj et al.   CARBON

Comprehensive reaction mechanism for n-butanol pyrolysis and combustion

(2010) Michael R. Harper et al.   COMBUSTION AND FLAME

Efficient and Accurate Double-Hybrid-Meta-GGA Density Functionals—Evaluation with the Extended GMTKN30 Database for General Main Group Thermochemistry, Kinetics, and Noncovalent Interactions

(2010) Lars Goerigk et al.   Journal of Chemical Theory and Computation

Bay-capping reactions: Kinetics and influence on graphene-edge growth

(2010) Xiaoqing You et al.   PROCEEDINGS OF THE COMBUSTION INSTITUTE

A new shock tube study of the H+O2→OH+O reaction rate using tunable diode laser absorption of H2O near 2.5μm

(2010) Z. Hong et al.   PROCEEDINGS OF THE COMBUSTION INSTITUTE

New polycyclic aromatic hydrocarbon (PAH) surface processes to improve the model prediction of the composition of combustion-generated PAHs and soot

(2009) Abhijeet Raj et al.   CARBON

Development of reactor models of a diffusion combustion chamber for comparative analysis of detailed and reduced kinetic schemes of combustion of hydrocarbon fuels

(2009) V. M. Zakharov et al.   COMBUSTION EXPLOSION AND SHOCK WAVES

Simplified CCSD(T)-F12 methods: Theory and benchmarks

(2009) Gerald Knizia et al.   JOURNAL OF CHEMICAL PHYSICS

Detailed Kinetic Monte Carlo Simulations of Graphene-Edge Growth

(2009) Russell Whitesides et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Shock-Tube Study of the Reactions of Hydrogen Atoms with Benzene and Phenyl Radicals

(2009) Binod R. Giri et al.   ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS

Modelling soot formation in a premixed flame using an aromatic-site soot model and an improved oxidation rate

(2008) Matthew S. Celnik et al.   PROCEEDINGS OF THE COMBUSTION INSTITUTE

A review of features in current automatic generation software for hydrocarbon oxidation mechanisms

(2007) Sauro Pierucci et al.   COMPUTERS & CHEMICAL ENGINEERING