19 results on '"Broadbelt, Linda J."'
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2. Application and comparison of derivative-free optimization algorithms to control and optimize free radical polymerization simulated using the kinetic Monte Carlo method
3. Role of neighboring domains in determining the magnitude and direction of Tg-confinement effects in binary, immiscible polymer systems
4. The impact of adhesion peptides within hydrogels on the phenotype and signaling of normal and cancerous mammary epithelial cells
5. Detailed mechanistic modeling of poly(styrene peroxide) pyrolysis using kinetic Monte Carlo simulation
6. Detailed mechanistic modeling of high-density polyethylene pyrolysis: Low molecular weight product evolution
7. Reaction pathways to dimer in polystyrene pyrolysis: A mechanistic modeling study
8. Transmission probabilities and particle–wall contact for Knudsen diffusion in pores of variable diameter
9. Elucidation of structure–reactivity relationships in hindered phenols via quantum chemistry and transition state theory
10. A group additivity approach for the prediction of wavelength-dependent absorption cross-sections
11. Computational discovery of biochemical routes to specialty chemicals
12. Binary mixture pyrolysis of polystyrene and poly(α-methylstyrene)
13. A density-functional study of the interaction of nitrogen with ruthenium clusters
14. Construction of a mechanistic model of Fischer–Tropsch synthesis on Ni(1 1 1) and Co(0 0 0 1) surfaces
15. Kinetic and mechanistic studies of proline-mediated direct intermolecular aldol reactions
16. Thermal stability and degradation of aromatic polyamides. Part 2. Structure-reactivity relationships in the pyrolysis and hydrolysis of benzamides
17. Thermal stability and degradation of aromatic polyamides. 1. Pyrolysis and hydrolysis pathways, kinetics and mechanisms of N-phenylbenzamide
18. Necessary levels of detail in microkinetic models of catalytic reactions on nonuniform surfaces
19. Computer generated reaction networks: on-the-fly calculation of species properties using computational quantum chemistry
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