Emily presented the latest advancements in RMG-Cat at 26th North American Catalysis Society Meeting which took place in Chicago from 23-28 June 2019. E. Mazeau, K. Blondal, C. F. Goldsmith, and R. H. West. Automated Construction of Microkinetic Models with RMG-Cat for Mapping the Degree of Rate Control. 26th North American Catalysis Society Meeting (NAM26). […]
Prof. West and Nate presented AutoTST-2.0 at International Numerical Conference on Combustion which took place in Aachen, Germany from 6 – 8 May 2019 R. H. West and N. Harms. AutoTST: automated transition state theory calculations for high- throughput calculation of chemical kinetics. 17th International Conference on Numerical Combustion. Aachen, Germany. 6 – 8 May […]
Aberdeen Dinius, an undergraduate researcher in the CoMoChEng lab, won both the Outstanding Student Research award in the Engineering and Technology (Undergraduate) category and the overall RISE Excellence in Innovation award (with $1,000 cash) at Northeastern’s Research Innovation and Scholarship Expo (RISE) 2019 for her research poster titled “Transition State Theory Calculations for Hydrogen Abstractions […]
The 11th national combustion meeting took place in Pasadena, CA from 24-27th March 2019, where Prof. West and David presented three talks. K. E. Niemeyer, R. L. Speth, B. W. Weber, and R. H. West. A review of evidence-based best practices for developing research software in combustion. 11th US National Combustion Meeting. Pasadena, California. 24 […]
The 2nd RISE Expo took place on 4th March 2019 where undergraduate students Carl, Aberdeen, Ben, and Anthony presented three posters. 1. C. Underkoffler, N. Harms, and R. H. West. Including 1-D hindered rotors of molecular geometry in automated transition state theory calculations. RISE: Research, Innovation, and Scholarship Expo. Northeastern University, Boston, MA. 4th April […]
The Annual AIChE national meeting took place at David L. Lawrence Center, Pittsburgh from October 28 – November 2, where Nate, Krishna, and Emily presented three talks. N. D. Harms, S. K. Sirumalla†, and R. H. West. Assessing Discrepancies in Kinetic Parameters and Improving Combustion Models through Metaheuristic Optimization. AIChE Annual Meeting. Pittsburgh, PA. 28 […]
The 256th American Chemical Society (ACS) National Meeting took place in Boston from 19 – 23 August 2018, where Nate, Krishna, and Richard presented six talks and a poster, including work by Emily and Rasha. N. D. Harms and R. H. West. Implementing genetic algorithms and evolutionary strategies in conformer analysis. 256th ACS National Meeting. […]