화학공학소재연구정보센터
검색결과 : 27건
No. Article
1 Predicted Reaction Mechanisms, Product Speciation, Kinetics, and Detonation Properties of the Insensitive Explosive 2,6-Diamino-3,5-dinitropyrazine-1-oxide (LLM-105)
Hamilton BW, Steele BA, Sakano MN, Kroonblawd MP, Kuo IFW, Strachan A
Journal of Physical Chemistry A, 125(8), 1766, 2021
2 Nitromethane Decomposition via Automated Reaction Discovery and an Ab Initio Corrected Kinetic Model
Ford J, Seritan S, Zhu XL, Sakano MN, Islam MM, Strachan A, Martinez TJ
Journal of Physical Chemistry A, 125(7), 1447, 2021
3 Unsupervised Learning-Based Multiscale Model of Thermochemistry in 1,3,5-Trinitro-1,3,5-triazinane (RDX)
Sakano MN, Hamed A, Kober EM, Grilli N, Hamilton BW, Islam MM, Koslowski M, Strachan A
Journal of Physical Chemistry A, 124(44), 9141, 2020
4 Insight into the Chemistry of PETN Under Shock Compression Through Ultrafast Broadband Mid-Infrared Absorption Spectroscopy
Powell MS, Sakano MN, Cawkwell MJ, Bowlan PR, Brown KE, Bolme CA, Moore DS, Son SF, Strachan A, McGrane SD
Journal of Physical Chemistry A, 124(35), 7031, 2020
5 Universality in Spatio-Temporal High-Mobility Domains Across the Glass Transition from Bulk Polymers to Single Chains
Alzate-Vargas L, Onofrio N, Strachan A
Macromolecules, 53(21), 9375, 2020
6 Prediction of PEKK properties related to crystallization by molecular dynamics simulations with a united-atom model
Li CY, Strachan A
Polymer, 174, 25, 2019
7 Cohesive energy density and solubility parameter evolution during the curing of thermoset
Li CY, Strachan A
Polymer, 135, 162, 2018
8 Coarse-grained molecular dynamics modeling of reaction-induced phase separation
Li CY, Strachan A
Polymer, 149, 30, 2018
9 Crystalline and pseudo-crystalline phases of polyacrylonitrile from molecular dynamics: Implications for carbon fiber precursors
Shen TT, Li CY, Haley B, Desai S, Strachan A
Polymer, 155, 13, 2018
10 Effects of water on epoxy cure kinetics and glass transition temperature utilizing molecular dynamics simulations
Sharp N, Li CY, Strachan A, Adams D, Pipes RB
Journal of Polymer Science Part B: Polymer Physics, 55(15), 1150, 2017