Bhargava BL - Search Results

1

Self-Assembly of Cations in Aqueous Solutions of Hydroxyl-Functionalized Ionic Liquids: Molecular Dynamics Studies.

Palchowdhury S, Bhargava BL. Palchowdhury S, et al. Among authors: bhargava bl. J Phys Chem B. 2015 Sep 3;119(35):11815-24. doi: 10.1021/acs.jpcb.5b06151. Epub 2015 Aug 13. J Phys Chem B. 2015. PMID: 26256805

2

Ab initio molecular dynamics simulation of a 1-ethyl-3-methylimidazolium fluoride-hydrogen fluoride mixture.

Bhargava BL, Balasubramanian S. Bhargava BL, et al. J Phys Chem B. 2008 Jun 26;112(25):7566-73. doi: 10.1021/jp801323g. Epub 2008 May 30. J Phys Chem B. 2008. PMID: 18512890

3

Molecular dynamics studies of cation aggregation in the room temperature ionic liquid [C10mim][Br] in aqueous solution.

Bhargava BL, Klein ML. Bhargava BL, et al. J Phys Chem A. 2009 Mar 12;113(10):1898-904. doi: 10.1021/jp8068865. J Phys Chem A. 2009. PMID: 18855371

4

Initial stages of aggregation in aqueous solutions of ionic liquids: molecular dynamics studies.

Bhargava BL, Klein ML. Bhargava BL, et al. J Phys Chem B. 2009 Jul 16;113(28):9499-505. doi: 10.1021/jp903560y. J Phys Chem B. 2009. PMID: 19537746

5

Nanoclusters of room temperature ionic liquids: a molecular dynamics simulation study.

Sarangi SS, Bhargava BL, Balasubramanian S. Sarangi SS, et al. Among authors: bhargava bl. Phys Chem Chem Phys. 2009 Oct 21;11(39):8745-51. doi: 10.1039/b908339a. Epub 2009 Jul 28. Phys Chem Chem Phys. 2009. PMID: 20449018

6

Nanoscale organization in aqueous dicationic ionic liquid solutions.

Bhargava BL, Klein ML. Bhargava BL, et al. J Phys Chem B. 2011 Sep 8;115(35):10439-46. doi: 10.1021/jp204413n. Epub 2011 Aug 11. J Phys Chem B. 2011. PMID: 21797249

7

Effect of cation asymmetry on the aggregation in aqueous 1-alkyl,3-decylimidazolium bromide solutions: molecular dynamics studies.

Palchowdhury S, Bhargava BL. Palchowdhury S, et al. Among authors: bhargava bl. J Phys Chem B. 2014 Jun 12;118(23):6241-9. doi: 10.1021/jp503301d. Epub 2014 Jun 2. J Phys Chem B. 2014. PMID: 24848590

8

Ionic liquids at nonane-water interfaces: molecular dynamics studies.

Palchowdhury S, Bhargava BL. Palchowdhury S, et al. Among authors: bhargava bl. J Phys Chem B. 2014 Dec 4;118(48):13930-9. doi: 10.1021/jp508950k. Epub 2014 Nov 21. J Phys Chem B. 2014. PMID: 25387241

9

Effect of spacer chain length on the liquid structure of aqueous dicationic ionic liquid solutions: molecular dynamics studies.

Palchowdhury S, Bhargava BL. Palchowdhury S, et al. Among authors: bhargava bl. Phys Chem Chem Phys. 2015 May 7;17(17):11627-37. doi: 10.1039/c5cp00873e. Phys Chem Chem Phys. 2015. PMID: 25865828

10

Segregation of ions at the interface: molecular dynamics studies of the bulk and liquid-vapor interface structure of equimolar binary mixtures of ionic liquids.

Palchowdhury S, Bhargava BL. Palchowdhury S, et al. Among authors: bhargava bl. Phys Chem Chem Phys. 2015 Aug 14;17(30):19919-28. doi: 10.1039/c5cp02932e. Epub 2015 Jul 13. Phys Chem Chem Phys. 2015. PMID: 26166036

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