Bakó I - Search Results

1

Properties of Hydrogen-Bonded Networks in Ethanol-Water Liquid Mixtures as a Function of Temperature: Diffraction Experiments and Computer Simulations.

Pothoczki S, Pethes I, Pusztai L, Temleitner L, Ohara K, Bakó I. Pothoczki S, et al. Among authors: bako i. J Phys Chem B. 2021 Jun 17;125(23):6272-6279. doi: 10.1021/acs.jpcb.1c03122. Epub 2021 Jun 3. J Phys Chem B. 2021. PMID: 34078085 Free PMC article.

2

Water-methanol mixtures: topology of hydrogen bonded network.

Bakó I, Megyes T, Bálint S, Grósz T, Chihaia V. Bakó I, et al. Phys Chem Chem Phys. 2008 Aug 28;10(32):5004-11. doi: 10.1039/b808326f. Epub 2008 Jul 8. Phys Chem Chem Phys. 2008. PMID: 18688546

3

Benchmarking polarizable molecular dynamics simulations of aqueous sodium hydroxide by diffraction measurements.

Vácha R, Megyes T, Bakó I, Pusztai L, Jungwirth P. Vácha R, et al. Among authors: bako i. J Phys Chem A. 2009 Apr 23;113(16):4022-7. doi: 10.1021/jp810399p. J Phys Chem A. 2009. PMID: 19209921

4

Solution structure of NaNO3 in water: diffraction and molecular dynamics simulation study.

Megyes T, Bálint S, Peter E, Grósz T, Bakó I, Krienke H, Bellissent-Funel MC. Megyes T, et al. Among authors: bako i. J Phys Chem B. 2009 Apr 2;113(13):4054-64. doi: 10.1021/jp806411c. J Phys Chem B. 2009. PMID: 19231825

5

Hydrogen bond network topology in liquid water and methanol: a graph theory approach.

Bakó I, Bencsura A, Hermannson K, Bálint S, Grósz T, Chihaia V, Oláh J. Bakó I, et al. Phys Chem Chem Phys. 2013 Sep 28;15(36):15163-71. doi: 10.1039/c3cp52271g. Phys Chem Chem Phys. 2013. PMID: 23925551

6

Hierarchy of the Collective Effects in Water Clusters.

Bakó I, Mayer I. Bakó I, et al. J Phys Chem A. 2016 Feb 4;120(4):631-8. doi: 10.1021/acs.jpca.5b10053. Epub 2016 Jan 20. J Phys Chem A. 2016. PMID: 26771891

7

On Dipole Moments and Hydrogen Bond Identification in Water Clusters.

Bakó I, Mayer I. Bakó I, et al. J Phys Chem A. 2016 Jun 30;120(25):4408-17. doi: 10.1021/acs.jpca.6b03187. Epub 2016 Jun 17. J Phys Chem A. 2016. PMID: 27280888

8

Decreasing temperature enhances the formation of sixfold hydrogen bonded rings in water-rich water-methanol mixtures.

Bakó I, Pusztai L, Temleitner L. Bakó I, et al. Sci Rep. 2017 Apr 21;7(1):1073. doi: 10.1038/s41598-017-01095-7. Sci Rep. 2017. PMID: 28432304 Free PMC article.

9

Variations of the Hydrogen Bonding and Hydrogen-Bonded Network in Ethanol-Water Mixtures on Cooling.

Pothoczki S, Pusztai L, Bakó I. Pothoczki S, et al. Among authors: bako i. J Phys Chem B. 2018 Jul 5;122(26):6790-6800. doi: 10.1021/acs.jpcb.8b02493. Epub 2018 Jun 25. J Phys Chem B. 2018. PMID: 29893130

10

Molecular Dynamics Simulation Studies of the Temperature-Dependent Structure and Dynamics of Isopropanol-Water Liquid Mixtures at Low Alcohol Content.

Pothoczki S, Pusztai L, Bakó I. Pothoczki S, et al. Among authors: bako i. J Phys Chem B. 2019 Sep 5;123(35):7599-7610. doi: 10.1021/acs.jpcb.9b05631. Epub 2019 Aug 26. J Phys Chem B. 2019. PMID: 31405282 Free article.

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