Schenter GK - Search Results

1

Correlation function approach for diffusion in confined geometries.

Palmer BJ, Chun J, Morris JF, Mundy CJ, Schenter GK. Palmer BJ, et al. Among authors: schenter gk. Phys Rev E. 2020 Aug;102(2-1):022129. doi: 10.1103/PhysRevE.102.022129. Phys Rev E. 2020. PMID: 32942374

2

Activation energies and potentials of mean force for water cluster evaporation.

Kathmann SM, Palmer BJ, Schenter GK, Garrett BC. Kathmann SM, et al. Among authors: schenter gk. J Chem Phys. 2008 Feb 14;128(6):064306. doi: 10.1063/1.2837282. J Chem Phys. 2008. PMID: 18282037

3

Self-consistent polarization density functional theory: application to argon.

Maerzke KA, Murdachaew G, Mundy CJ, Schenter GK, Siepmann JI. Maerzke KA, et al. Among authors: schenter gk. J Phys Chem A. 2009 Mar 12;113(10):2075-85. doi: 10.1021/jp808767y. J Phys Chem A. 2009. PMID: 19260723

4

Neutron powder diffraction and molecular simulation study of the structural evolution of ammonia borane from 15 to 340 K.

Hess NJ, Schenter GK, Hartman MR, Daemen LL, Proffen T, Kathmann SM, Mundy CJ, Hartl M, Heldebrant DJ, Stowe AC, Autrey T. Hess NJ, et al. Among authors: schenter gk. J Phys Chem A. 2009 May 14;113(19):5723-35. doi: 10.1021/jp900839c. J Phys Chem A. 2009. PMID: 19374410

5

Improving the density functional theory description of water with self-consistent polarization.

Murdachaew G, Mundy CJ, Schenter GK. Murdachaew G, et al. Among authors: schenter gk. J Chem Phys. 2010 Apr 28;132(16):164102. doi: 10.1063/1.3385797. J Chem Phys. 2010. PMID: 20441253

6

Probing the hydration structure of polarizable halides: a multiedge XAFS and molecular dynamics study of the iodide anion.

Fulton JL, Schenter GK, Baer MD, Mundy CJ, Dang LX, Balasubramanian M. Fulton JL, et al. Among authors: schenter gk. J Phys Chem B. 2010 Oct 14;114(40):12926-37. doi: 10.1021/jp106378p. J Phys Chem B. 2010. PMID: 20849138

7

Semiempirical self-consistent polarization description of bulk water, the liquid-vapor interface, and cubic ice.

Murdachaew G, Mundy CJ, Schenter GK, Laino T, Hutter J. Murdachaew G, et al. Among authors: schenter gk. J Phys Chem A. 2011 Jun 16;115(23):6046-53. doi: 10.1021/jp110481m. Epub 2011 Mar 3. J Phys Chem A. 2011. PMID: 21370904 Free article.

8

Understanding the surface potential of water.

Kathmann SM, Kuo IF, Mundy CJ, Schenter GK. Kathmann SM, et al. Among authors: schenter gk. J Phys Chem B. 2011 Apr 21;115(15):4369-77. doi: 10.1021/jp1116036. Epub 2011 Mar 30. J Phys Chem B. 2011. PMID: 21449605

9

Persistent ion pairing in aqueous hydrochloric acid.

Baer MD, Fulton JL, Balasubramanian M, Schenter GK, Mundy CJ. Baer MD, et al. Among authors: schenter gk. J Phys Chem B. 2014 Jul 3;118(26):7211-20. doi: 10.1021/jp501091h. Epub 2014 Jun 3. J Phys Chem B. 2014. PMID: 24837190

10

The role of solvent heterogeneity in determining the dispersion interaction between nanoassemblies.

Chun J, Mundy CJ, Schenter GK. Chun J, et al. Among authors: schenter gk. J Phys Chem B. 2015 May 7;119(18):5873-81. doi: 10.1021/jp512550c. Epub 2015 Apr 24. J Phys Chem B. 2015. PMID: 25872971

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