Accelerating the Calculation of Solute–Solvent Interaction Energies through Systematic Molecular Fragmentation

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.9b06041 ◽

2019 ◽

Vol 123 (39) ◽

pp. 8476-8484 ◽

Cited By ~ 1

Author(s):

Michael A. Collins ◽

Junming Ho

Keyword(s):

Interaction Energies ◽

Solvent Interaction ◽

Molecular Fragmentation ◽

Solute Solvent Interaction

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Solvent effects on electronic absorption spectra of nitrochlorobenzenes, nitrophenols and nitroanilines—lll. Excited state dipole moments and specific solute—solvent interaction energies employing Bakhshiev's approach

Spectrochimica Acta Part A Molecular Spectroscopy ◽

10.1016/0584-8539(89)80194-1 ◽

1989 ◽

Vol 45 (11) ◽

pp. 1147-1155 ◽

Cited By ~ 7

Author(s):

L.S.Prabhu Mirashi ◽

S.S. Kunte

Keyword(s):

Excited State ◽

Absorption Spectra ◽

Electronic Absorption ◽

Solvent Effects ◽

Electronic Absorption Spectra ◽

Dipole Moments ◽

Interaction Energies ◽

Solvent Interaction ◽

Solute Solvent Interaction ◽

Excited State Dipole Moments

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Solvent extraction of mineral acids. IV. Solute-solvent interaction in the system perchloric acid-water-tri-N-butyl phosphate

Journal of Biochemical Toxicology ◽

10.1002/jbt.2570100704 ◽

1960 ◽

Vol 10 (7) ◽

pp. 287-292

Author(s):

A. S. Kertes ◽

V. Kertes

Keyword(s):

Solvent Extraction ◽

Perchloric Acid ◽

Acid Water ◽

Solvent Interaction ◽

Mineral Acids ◽

Solute Solvent Interaction

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Ultrasonic and Thermodynamic Study on Solute-Solvent Interaction. Binary Mixtures oft-Butyl Chloride,t-Butyl Bromide and 1,1,1-Trichloroethane with Carbon Tetrachloride, Benzene andp-Xylene

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.44.1224 ◽

1971 ◽

Vol 44 (5) ◽

pp. 1224-1230 ◽

Cited By ~ 14

Author(s):

Osamu Kiyohara ◽

Kiyoshi Arakawa

Keyword(s):

Carbon Tetrachloride ◽

Binary Mixtures ◽

Thermodynamic Study ◽

Butyl Chloride ◽

Butyl Bromide ◽

Solvent Interaction ◽

Solute Solvent Interaction

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Solute-solvent interaction in liquids

Journal of Molecular Spectroscopy ◽

10.1016/0022-2852(78)90231-x ◽

1978 ◽

Vol 69 (3) ◽

pp. 383-393 ◽

Cited By ~ 9

Author(s):

George Turrell

Keyword(s):

Solvent Interaction ◽

Solute Solvent Interaction

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A Study of Solute–Solvent Interaction in Solvents of Medium Dielectric Constant from the Apparent Molal Volume Data. I

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.46.1973 ◽

1973 ◽

Vol 46 (7) ◽

pp. 1973-1976 ◽

Cited By ~ 16

Author(s):

Ram Gopal ◽

D. K. Agarwal ◽

Rajendra Kumar

Keyword(s):

Dielectric Constant ◽

Apparent Molal Volume ◽

Volume Data ◽

Molal Volume ◽

Solvent Interaction ◽

Solute Solvent Interaction

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Is Viscosity B Coefficient Characteristic for Solute-Solvent Interaction? [Journal of Molecular Liquids 63 (1995) 303]

Journal of Molecular Liquids ◽

10.1016/0167-7322(96)00953-1 ◽

1996 ◽

Vol 70 (1) ◽

pp. 105

Author(s):

Tetsuo Nakagawa

Keyword(s):

Molecular Liquids ◽

Solvent Interaction ◽

Solute Solvent Interaction ◽

Viscosity B Coefficient

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Toward Understanding Solute–Solvent Interaction in Room-Temperature Mono- and Dicationic Ionic Liquids: A Combined Fluorescence Spectroscopy and Mass Spectrometry Analysis

The Journal of Physical Chemistry B ◽

10.1021/jp500218r ◽

2014 ◽

Vol 118 (7) ◽

pp. 1907-1915 ◽

Cited By ~ 27

Author(s):

Prabhat Kumar Sahu ◽

Sudhir Kumar Das ◽

Moloy Sarkar

Keyword(s):

Mass Spectrometry ◽

Ionic Liquids ◽

Fluorescence Spectroscopy ◽

Room Temperature ◽

Mass Spectrometry Analysis ◽

Solvent Interaction ◽

Spectrometry Analysis ◽

Dicationic Ionic Liquids ◽

Solute Solvent Interaction

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Charge transfer to a solvent state. 5. Effect of solute-solvent interaction on the ionization potential of the solute. Mechanism for photoionization

The Journal of Physical Chemistry ◽

10.1021/j100446a006 ◽

1980 ◽

Vol 84 (9) ◽

pp. 964-970 ◽

Cited By ~ 20

Author(s):

T. B. Truong

Keyword(s):

Charge Transfer ◽

Ionization Potential ◽

Solvent Interaction ◽

Solute Solvent Interaction

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Estimation and interpretation of infinite dilution solute–solvent interaction enthalpies in non-electrolyte aqueous solutions

Thermochimica Acta ◽

10.1016/j.tca.2009.07.001 ◽

2009 ◽

Vol 496 (1-2) ◽

pp. 66-70 ◽

Cited By ~ 4

Author(s):

Michael I. Davis ◽

Gérard Douhéret ◽

João Carlos R. Reis

Keyword(s):

Aqueous Solutions ◽

Infinite Dilution ◽

Solvent Interaction ◽

Solute Solvent Interaction

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Molecular Interaction of Aqueous Solution of 1-Propanol and 2-Propanol

Oriental Journal Of Chemistry ◽

10.13005/ojc/350256 ◽

2019 ◽

Vol 35 (2) ◽

pp. 901-904

Author(s):

Sandhya Sharma ◽

N. D. Kandpal ◽

R. Joshi

Keyword(s):

Aqueous Solution ◽

Aqueous Solutions ◽

Molecular Interaction ◽

Aqueous Systems ◽

Solvent Interaction ◽

Solvent Type ◽

Type Interaction ◽

Alcohol System ◽

Solute Solvent Interaction ◽

Water Alcohol

Viscosities (ƞ) of solutions of 1- propanol and 2-propanol have been determined in aqueous systems of varying composition (0.16-3.64 mol dm-3) at 298 K. The ƞ/ƞ0 data have been analyzed in the light of reduced Jone-Dole equation ƞ/ƞ0 = BC+1. The results in the regards to solute-solvent interaction in aqueous solutions of both the alcohols have been discussed in the terms of the value B. The result of study reveals that both the alcohols behave as the structure makers in the water. The result shows that solute-solvent type interaction of same magnitude exists in water-alcohol system.

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