Strachan A - Search Results

1

Thermal decomposition of condensed-phase nitromethane from molecular dynamics from ReaxFF reactive dynamics.

Han SP, van Duin AC, Goddard WA 3rd, Strachan A. Han SP, et al. Among authors: strachan a. J Phys Chem B. 2011 May 26;115(20):6534-40. doi: 10.1021/jp1104054. Epub 2011 May 4. J Phys Chem B. 2011. PMID: 21542572

2

Shock waves in high-energy materials: the initial chemical events in nitramine RDX.

Strachan A, van Duin AC, Chakraborty D, Dasgupta S, Goddard WA 3rd. Strachan A, et al. Phys Rev Lett. 2003 Aug 29;91(9):098301. doi: 10.1103/PhysRevLett.91.098301. Epub 2003 Aug 28. Phys Rev Lett. 2003. PMID: 14525217

3

Thermal decomposition of RDX from reactive molecular dynamics.

Strachan A, Kober EM, van Duin AC, Oxgaard J, Goddard WA. Strachan A, et al. J Chem Phys. 2005 Feb 1;122(5):54502. doi: 10.1063/1.1831277. J Chem Phys. 2005. PMID: 15740334

4

Coupled thermal and electromagnetic induced decomposition in the molecular explosive αHMX; a reactive molecular dynamics study.

Wood MA, van Duin AC, Strachan A. Wood MA, et al. Among authors: strachan a. J Phys Chem A. 2014 Feb 6;118(5):885-95. doi: 10.1021/jp406248m. Epub 2014 Jan 22. J Phys Chem A. 2014. PMID: 24400687

5

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. Powell MS, et al. Among authors: strachan a. J Phys Chem A. 2020 Sep 3;124(35):7031-7046. doi: 10.1021/acs.jpca.0c03917. Epub 2020 Aug 19. J Phys Chem A. 2020. PMID: 32786976

6

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. Sakano MN, et al. Among authors: strachan a. J Phys Chem A. 2020 Nov 5;124(44):9141-9155. doi: 10.1021/acs.jpca.0c07320. Epub 2020 Oct 28. J Phys Chem A. 2020. PMID: 33112131

7

Nitromethane Decomposition via Automated Reaction Discovery and an Ab Initio Corrected Kinetic Model.

Ford J, Seritan S, Zhu X, Sakano MN, Islam MM, Strachan A, Martínez TJ. Ford J, et al. Among authors: strachan a. J Phys Chem A. 2021 Feb 25;125(7):1447-1460. doi: 10.1021/acs.jpca.0c09168. Epub 2021 Feb 11. J Phys Chem A. 2021. PMID: 33569957

8

Atomistic Insights on the Full Operation Cycle of a HfO₂-Based Resistive Random Access Memory Cell from Molecular Dynamics.

Urquiza ML, Islam MM, van Duin ACT, Cartoixà X, Strachan A. Urquiza ML, et al. Among authors: strachan a. ACS Nano. 2021 Aug 24;15(8):12945-12954. doi: 10.1021/acsnano.1c01466. Epub 2021 Jul 30. ACS Nano. 2021. PMID: 34329560 Free article.

9

Melting dynamics of superheated argon: nucleation and growth.

Luo SN, Zheng L, Strachan A, Swift DC. Luo SN, et al. Among authors: strachan a. J Chem Phys. 2007 Jan 21;126(3):034505. doi: 10.1063/1.2424715. J Chem Phys. 2007. PMID: 17249882

10

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 IW, Strachan A. Hamilton BW, et al. Among authors: strachan a. J Phys Chem A. 2021 Mar 4;125(8):1766-1777. doi: 10.1021/acs.jpca.0c10946. Epub 2021 Feb 22. J Phys Chem A. 2021. PMID: 33617263

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