Matubayasi N - Search Results

1

Transport Properties of Ionic Liquid and Sodium Salt Mixtures for Sodium-Ion Battery Electrolytes from Molecular Dynamics Simulation with a Self-Consistent Atomic Charge Determination.

Hakim L, Ishii Y, Matsumoto K, Hagiwara R, Ohara K, Umebayashi Y, Matubayasi N. Hakim L, et al. Among authors: matubayasi n. J Phys Chem B. 2020 Aug 20;124(33):7291-7305. doi: 10.1021/acs.jpcb.0c04078. Epub 2020 Aug 6. J Phys Chem B. 2020. PMID: 32786718

2

Controlling the equilibrium of formic acid with hydrogen and carbon dioxide using ionic liquid.

Yasaka Y, Wakai C, Matubayasi N, Nakahara M. Yasaka Y, et al. Among authors: matubayasi n. J Phys Chem A. 2010 Mar 18;114(10):3510-5. doi: 10.1021/jp908174s. J Phys Chem A. 2010. PMID: 20166690

3

NMR-NOE and MD simulation study on phospholipid membranes: dependence on membrane diameter and multiple time scale dynamics.

Shintani M, Yoshida K, Sakuraba S, Nakahara M, Matubayasi N. Shintani M, et al. Among authors: matubayasi n. J Phys Chem B. 2011 Jul 28;115(29):9106-15. doi: 10.1021/jp204051f. Epub 2011 Jul 5. J Phys Chem B. 2011. PMID: 21728286

4

Free-energy and structural analysis of ion solvation and contact ion-pair formation of Li(+) with BF4(-) and PF6(-) in water and carbonate solvents.

Takeuchi M, Matubayasi N, Kameda Y, Minofar B, Ishiguro S, Umebayashi Y. Takeuchi M, et al. Among authors: matubayasi n. J Phys Chem B. 2012 Jun 7;116(22):6476-87. doi: 10.1021/jp3011487. Epub 2012 May 22. J Phys Chem B. 2012. PMID: 22616851

5

Comparative study on the properties of hydration water of Na- and K-halide ions by Raman OH/OD-stretching spectroscopy and dielectric relaxation data.

Okazaki Y, Taniuchi T, Mogami G, Matubayasi N, Suzuki M. Okazaki Y, et al. Among authors: matubayasi n. J Phys Chem A. 2014 Apr 24;118(16):2922-30. doi: 10.1021/jp412804d. Epub 2014 Apr 11. J Phys Chem A. 2014. PMID: 24673607

6

Energetic contributions from the cation and anion to the stability of carbon dioxide dissolved in imidazolium-based ionic liquids.

Ishizuka R, Matubayasi N, Tu KM, Umebayashi Y. Ishizuka R, et al. Among authors: matubayasi n. J Phys Chem B. 2015 Jan 29;119(4):1579-87. doi: 10.1021/jp5101957. Epub 2015 Jan 8. J Phys Chem B. 2015. PMID: 25569671

7

Self-Consistent Determination of Atomic Charges of Ionic Liquid through a Combination of Molecular Dynamics Simulation and Density Functional Theory.

Ishizuka R, Matubayasi N. Ishizuka R, et al. Among authors: matubayasi n. J Chem Theory Comput. 2016 Feb 9;12(2):804-11. doi: 10.1021/acs.jctc.5b00885. Epub 2016 Jan 21. J Chem Theory Comput. 2016. PMID: 26735302

8

Spatial-Decomposition Analysis of Energetics of Ionic Hydration.

Mogami G, Suzuki M, Matubayasi N. Mogami G, et al. Among authors: matubayasi n. J Phys Chem B. 2016 Mar 3;120(8):1813-21. doi: 10.1021/acs.jpcb.5b09481. Epub 2016 Jan 19. J Phys Chem B. 2016. PMID: 26784859

9

Relationship between Solvation Thermodynamics from IST and DFT Perspectives.

Levy RM, Cui D, Zhang BW, Matubayasi N. Levy RM, et al. Among authors: matubayasi n. J Phys Chem B. 2017 Apr 20;121(15):3825-3841. doi: 10.1021/acs.jpcb.6b12889. Epub 2017 Feb 28. J Phys Chem B. 2017. PMID: 28186751 Free PMC article. Review.

10

Drastic Compensation of Electronic and Solvation Effects on ATP Hydrolysis Revealed through Large-Scale QM/MM Simulations Combined with a Theory of Solutions.

Takahashi H, Umino S, Miki Y, Ishizuka R, Maeda S, Morita A, Suzuki M, Matubayasi N. Takahashi H, et al. Among authors: matubayasi n. J Phys Chem B. 2017 Mar 16;121(10):2279-2287. doi: 10.1021/acs.jpcb.7b00637. Epub 2017 Mar 7. J Phys Chem B. 2017. PMID: 28222598

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