Baer MD - Search Results

1

Interfacial behavior of perchlorate versus chloride ions in aqueous solutions.

Baer MD, Kuo IF, Bluhm H, Ghosal S. Baer MD, et al. J Phys Chem B. 2009 Dec 3;113(48):15843-50. doi: 10.1021/jp9053154. J Phys Chem B. 2009. PMID: 19929011

2

Inverse temperature transition of a biomimetic elastin model: reactive flux analysis of folding/unfolding and its coupling to solvent dielectric relaxation.

Baer M, Schreiner E, Kohlmeyer A, Rousseau R, Marx D. Baer M, et al. J Phys Chem B. 2006 Mar 2;110(8):3576-87. doi: 10.1021/jp054805a. J Phys Chem B. 2006. PMID: 16494413

3

Conformational dynamics of minimal elastin-like polypeptides: the role of proline revealed by molecular dynamics and nuclear magnetic resonance.

Glaves R, Baer M, Schreiner E, Stoll R, Marx D. Glaves R, et al. Chemphyschem. 2008 Dec 22;9(18):2759-65. doi: 10.1002/cphc.200800474. Chemphyschem. 2008. PMID: 18972488

4

Interpreting vibrational sum-frequency spectra of sulfur dioxide at the air/water interface: a comprehensive molecular dynamics study.

Baer M, Mundy CJ, Chang TM, Tao FM, Dang LX. Baer M, et al. J Phys Chem B. 2010 Jun 3;114(21):7245-9. doi: 10.1021/jp100310s. J Phys Chem B. 2010. PMID: 20446719

5

Spectral signatures of the pentagonal water cluster in bacteriorhodopsin.

Baer M, Mathias G, Kuo IF, Tobias DJ, Mundy CJ, Marx D. Baer M, et al. Chemphyschem. 2008 Dec 22;9(18):2703-7. doi: 10.1002/cphc.200800473. Chemphyschem. 2008. PMID: 19025752 No abstract available.

6

Potential proton-release channels in bacteriorhodopsin.

Chaumont A, Baer M, Mathias G, Marx D. Chaumont A, et al. Chemphyschem. 2008 Dec 22;9(18):2751-8. doi: 10.1002/cphc.200800471. Chemphyschem. 2008. PMID: 19035376

7

Assigning predissociation infrared spectra of microsolvated hydronium cations H3O(+)⋅(H2)n (n=0, 1, 2, 3) by ab initio molecular dynamics.

Baer M, Marx D, Mathias G. Baer M, et al. Chemphyschem. 2011 Jul 11;12(10):1906-15. doi: 10.1002/cphc.201000955. Epub 2011 Mar 16. Chemphyschem. 2011. PMID: 21413111

8

Simulation and theory of ions at atmospherically relevant aqueous liquid-air interfaces.

Tobias DJ, Stern AC, Baer MD, Levin Y, Mundy CJ. Tobias DJ, et al. Among authors: baer md. Annu Rev Phys Chem. 2013;64:339-59. doi: 10.1146/annurev-physchem-040412-110049. Epub 2013 Jan 16. Annu Rev Phys Chem. 2013. PMID: 23331311

9

Toward a unified picture of the water self-ions at the air-water interface: a density functional theory perspective.

Baer MD, Kuo IF, Tobias DJ, Mundy CJ. Baer MD, et al. J Phys Chem B. 2014 Jul 17;118(28):8364-72. doi: 10.1021/jp501854h. Epub 2014 May 12. J Phys Chem B. 2014. PMID: 24762096

10

Persistent ion pairing in aqueous hydrochloric acid.

Baer MD, Fulton JL, Balasubramanian M, Schenter GK, Mundy CJ. Baer MD, et al. 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

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