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Page 1
The master equation: general discussion.
Aerssens J, Burke MP, Cavallotti C, Green NJB, Green WH, Guo H, Heard D, Hochlaf M, Jasper AW, Klippenstein SJ, Kuwata KT, Lawrence JE, Mebel AM, Mullin AS, Nguyen TL, Olzmann M, Osborn DL, Pfeifle M, Plane JMC, Robertson PA, Robertson SH, Salzburger M, Seakins PW, Shannon RJ, Shiels OJ, Trevitt AJ, Vallance C, Welz O, Xu X, Zádor J, Zhang RM. Aerssens J, et al. Among authors: welz o. Faraday Discuss. 2022 Oct 21;238(0):529-574. doi: 10.1039/d2fd90050e. Faraday Discuss. 2022. PMID: 36222351 No abstract available.
New Insights into Low-Temperature Oxidation of Propane from Synchrotron Photoionization Mass Spectrometry and Multiscale Informatics Modeling.
Welz O, Burke MP, Antonov IO, Goldsmith CF, Savee JD, Osborn DL, Taatjes CA, Klippenstein SJ, Sheps L. Welz O, et al. J Phys Chem A. 2015 Jul 16;119(28):7116-29. doi: 10.1021/acs.jpca.5b01008. Epub 2015 May 1. J Phys Chem A. 2015. PMID: 25860187
The experimental results are modeled and interpreted using a multiscale informatics approach, presented in detail in a separate publication (Burke, M. P.; Goldsmith, C. F.; Klippenstein, S. J.; Welz, O.; Huang H.; Antonov I. O.; Savee J. D.; Osborn D. L.; Zad …
The experimental results are modeled and interpreted using a multiscale informatics approach, presented in detail in a separate publication …
The reaction step: general discussion.
Burke MP, Casavecchia P, Cavallotti C, Clary DC, Doner A, Green WH, Grinberg Dana A, Guo H, Heathcote D, Hochlaf M, Klippenstein SJ, Kuwata KT, Lawrence JE, Lourderaj U, Mebel AM, Milesevic D, Mullin AS, Nguyen TL, Olzmann M, Orr-Ewing AJ, Osborn DL, Pazdera TM, Robertson PA, Robinson MS, Rotavera B, Seakins PW, Shannon RJ, Shiels OJ, Suits AG, Trevitt AJ, Troe J, Vallance C, Welz O, Zhang F, Zádor J. Burke MP, et al. Among authors: welz o. Faraday Discuss. 2022 Oct 21;238(0):320-354. doi: 10.1039/d2fd90049a. Faraday Discuss. 2022. PMID: 36222439 No abstract available.
Impact of Lindemann and related theories: general discussion.
Bodi A, Burke MP, Butler AA, Douglas K, Eskola AJ, Green WH, Guo H, Heard DE, Heathcote D, Hochlaf M, Klippenstein SJ, Kuwata KT, Lawrence JE, Lester MI, Lourderaj U, Mebel AM, Milesevic D, Mullin AS, Nguyen TL, Olzmann M, Orr-Ewing AJ, Osborn DL, Pazdera TM, Pfeifle M, Plane JMC, Pun R, Robertson PA, Robinson MS, Seakins PW, Shannon RJ, Taatjes CA, Troe J, Vallance C, Welz O, Zádor J, Zhang F. Bodi A, et al. Among authors: welz o. Faraday Discuss. 2022 Oct 21;238(0):700-740. doi: 10.1039/d2fd90051c. Faraday Discuss. 2022. PMID: 36226887 No abstract available.
39 results