Format
Sort by
Items per page

Send to

Choose Destination

Links from PubMed

Items: 1 to 20 of 108

1.

On the ideality of binary mixtures of ionic liquids.

Brüssel M, Brehm M, Pensado AS, Malberg F, Ramzan M, Stark A, Kirchner B.

Phys Chem Chem Phys. 2012 Oct 14;14(38):13204-15. doi: 10.1039/c2cp41926b.

PMID:
22910970
2.

Ab initio molecular dynamics simulations of a binary system of ionic liquids.

Brüssel M, Brehm M, Voigt T, Kirchner B.

Phys Chem Chem Phys. 2011 Aug 14;13(30):13617-20. doi: 10.1039/c1cp21550g. Epub 2011 Jun 28.

PMID:
21709928
3.
4.

Ab initio prediction of proton NMR chemical shifts in imidazolium ionic liquids.

Chen S, Vijayaraghavan R, MacFarlane DR, Izgorodina EI.

J Phys Chem B. 2013 Mar 21;117(11):3186-97. doi: 10.1021/jp310267x. Epub 2013 Mar 7.

PMID:
23432338
5.

Molecular dynamics simulations of ionic liquids: cation and anion dependence of self-diffusion coefficients of ions.

Tsuzuki S, Shinoda W, Saito H, Mikami M, Tokuda H, Watanabe M.

J Phys Chem B. 2009 Aug 6;113(31):10641-9. doi: 10.1021/jp811128b.

PMID:
19591511
6.

A theoretical and experimental chemist's joint view on hydrogen bonding in ionic liquids and their binary mixtures.

Stark A, Brehm M, Brüssel M, Lehmann SB, Pensado AS, Schöppke M, Kirchner B.

Top Curr Chem. 2014;351:149-87. doi: 10.1007/128_2013_485.

PMID:
24682761
7.

Complex Structural and Dynamical Interplay of Cyano-Based Ionic Liquids.

Weber H, Kirchner B.

J Phys Chem B. 2016 Mar 10;120(9):2471-83. doi: 10.1021/acs.jpcb.6b00098. Epub 2016 Feb 24.

PMID:
26882454
8.

Proton transfer and polarity changes in ionic liquid-water mixtures: a perspective on hydrogen bonds from ab initio molecular dynamics at the example of 1-ethyl-3-methylimidazolium acetate-water mixtures--part 1.

Brehm M, Weber H, Pensado AS, Stark A, Kirchner B.

Phys Chem Chem Phys. 2012 Apr 21;14(15):5030-44. doi: 10.1039/c2cp23983c. Epub 2012 Mar 2.

PMID:
22389030
9.

On the role of the dipole and quadrupole moments of aromatic compounds in the solvation by ionic liquids.

Shimizu K, Costa Gomes MF, Pádua AA, Rebelo LP, Canongia Lopes JN.

J Phys Chem B. 2009 Jul 23;113(29):9894-900. doi: 10.1021/jp903556q.

PMID:
19569634
10.

Modeling the absorption of weak electrolytes and acid gases with ionic liquids using the soft-SAFT approach.

Llovell F, Marcos RM, MacDowell N, Vega LF.

J Phys Chem B. 2012 Jul 5;116(26):7709-18. doi: 10.1021/jp303344f. Epub 2012 Jun 21.

PMID:
22663142
11.

Raman and ab initio studies of simple and binary 1-alkyl-3-methylimidazolium ionic liquids.

Berg RW, Deetlefs M, Seddon KR, Shim I, Thompson JM.

J Phys Chem B. 2005 Oct 13;109(40):19018-25.

PMID:
16853448
12.

Modeling complex associating mixtures with [Cn-mim][Tf2N] ionic liquids: predictions from the soft-SAFT equation.

Llovell F, Valente E, Vilaseca O, Vega LF.

J Phys Chem B. 2011 Apr 21;115(15):4387-98. doi: 10.1021/jp112315b. Epub 2011 Mar 29.

PMID:
21446706
13.

Distributed polarizability models for imidazolium-based ionic liquids.

Millot C, Chaumont A, Engler E, Wipff G.

J Phys Chem A. 2014 Sep 25;118(38):8842-51. doi: 10.1021/jp505539y. Epub 2014 Sep 10.

PMID:
25133873
14.

Mixed ionic liquids: the case of pyridinium-based fluids.

Aparicio S, Atilhan M.

J Phys Chem B. 2012 Mar 1;116(8):2526-37. doi: 10.1021/jp212258b. Epub 2012 Feb 17.

PMID:
22309042
15.

Molecular dynamics study of polysaccharides in binary solvent mixtures of an ionic liquid and water.

Liu H, Sale KL, Simmons BA, Singh S.

J Phys Chem B. 2011 Sep 1;115(34):10251-8. doi: 10.1021/jp111738q. Epub 2011 Aug 9.

PMID:
21827163
16.

Phase behaviour, interactions, and structural studies of (amines+ionic liquids) binary mixtures.

Jacquemin J, Bendová M, Sedláková Z, Blesic M, Holbrey JD, Mullan CL, Youngs TG, Pison L, Wagner Z, Aim K, Costa Gomes MF, Hardacre C.

Chemphyschem. 2012 May 14;13(7):1825-35. doi: 10.1002/cphc.201100952. Epub 2012 Feb 29.

PMID:
22378633
17.

High-pressure study of the methylsulfate and tosylate imidazolium ionic liquids.

Aparicio S, Alcalde R, García B, Leal JM.

J Phys Chem B. 2009 Apr 23;113(16):5593-606. doi: 10.1021/jp9003467.

PMID:
19331328
18.

A novel united-atom force field for imidazolium-based ionic liquids.

Liu Z, Wu X, Wang W.

Phys Chem Chem Phys. 2006 Mar 7;8(9):1096-104. Epub 2006 Jan 3.

PMID:
16633591
19.

Improved united-atom force field for 1-alkyl-3-methylimidazolium chloride.

Liu Z, Chen T, Bell A, Smit B.

J Phys Chem B. 2010 Apr 8;114(13):4572-82. doi: 10.1021/jp911337f. Erratum in: J Phys Chem B. 2010 Aug 19;114(32):10692.

PMID:
20235515
20.

Supplemental Content

Support Center