Kohanoff J - Search Results

1

Efficient ab initio calculation of electronic stopping in disordered systems via geometry pre-sampling: Application to liquid water.

Gu B, Cunningham B, Muñoz Santiburcio D, Da Pieve F, Artacho E, Kohanoff J. Gu B, et al. Among authors: kohanoff j. J Chem Phys. 2020 Jul 21;153(3):034113. doi: 10.1063/5.0014276. J Chem Phys. 2020. PMID: 32716198

2

Dispersion interactions in room-temperature ionic liquids: results from a non-empirical density functional.

Kohanoff J, Pinilla C, Youngs TG, Artacho E, Soler JM. Kohanoff J, et al. J Chem Phys. 2011 Oct 21;135(15):154505. doi: 10.1063/1.3652897. J Chem Phys. 2011. PMID: 22029322

3

Inelastic scattering of electrons in water from first principles: cross sections and inelastic mean free path for use in Monte Carlo track-structure simulations of biological damage.

Koval NE, Koval P, Da Pieve F, Kohanoff J, Artacho E, Emfietzoglou D. Koval NE, et al. Among authors: kohanoff j. R Soc Open Sci. 2022 May 18;9(5):212011. doi: 10.1098/rsos.212011. eCollection 2022 May. R Soc Open Sci. 2022. PMID: 35619995 Free PMC article.

4

Protection of DNA against low-energy electrons by amino acids: a first-principles molecular dynamics study.

Gu B, Smyth M, Kohanoff J. Gu B, et al. Among authors: kohanoff j. Phys Chem Chem Phys. 2014 Nov 28;16(44):24350-8. doi: 10.1039/c4cp03906h. Phys Chem Chem Phys. 2014. PMID: 25301285

5

Water radiolysis by low-energy carbon projectiles from first-principles molecular dynamics.

Kohanoff J, Artacho E. Kohanoff J, et al. PLoS One. 2017 Mar 7;12(3):e0171820. doi: 10.1371/journal.pone.0171820. eCollection 2017. PLoS One. 2017. PMID: 28267804 Free PMC article.

6

Interactions between low energy electrons and DNA: a perspective from first-principles simulations.

Kohanoff J, McAllister M, Tribello GA, Gu B. Kohanoff J, et al. J Phys Condens Matter. 2017 Sep 27;29(38):383001. doi: 10.1088/1361-648X/aa79e3. Epub 2017 Jun 15. J Phys Condens Matter. 2017. PMID: 28617676

7

Electronic stopping power in gold: the role of d electrons and the H/He anomaly.

Zeb MA, Kohanoff J, Sánchez-Portal D, Arnau A, Juaristi JI, Artacho E. Zeb MA, et al. Among authors: kohanoff j. Phys Rev Lett. 2012 Jun 1;108(22):225504. doi: 10.1103/PhysRevLett.108.225504. Epub 2012 May 31. Phys Rev Lett. 2012. PMID: 23003620

8

Understanding the Interaction between Low-Energy Electrons and DNA Nucleotides in Aqueous Solution.

McAllister M, Smyth M, Gu B, Tribello GA, Kohanoff J. McAllister M, et al. Among authors: kohanoff j. J Phys Chem Lett. 2015 Aug 6;6(15):3091-7. doi: 10.1021/acs.jpclett.5b01011. Epub 2015 Jul 24. J Phys Chem Lett. 2015. PMID: 26267207

9

Solvation Effects on Dissociative Electron Attachment to Thymine.

McAllister M, Kazemigazestane N, Henry LT, Gu B, Fabrikant I, Tribello GA, Kohanoff J. McAllister M, et al. Among authors: kohanoff j. J Phys Chem B. 2019 Feb 21;123(7):1537-1544. doi: 10.1021/acs.jpcb.8b11621. Epub 2019 Feb 12. J Phys Chem B. 2019. PMID: 30694675

10

A tight binding model for water.

Paxton AT, Kohanoff JJ. Paxton AT, et al. Among authors: kohanoff jj. J Chem Phys. 2011 Jan 28;134(4):044130. doi: 10.1063/1.3523983. J Chem Phys. 2011. PMID: 21280710 Free article.

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