Publications

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1579 Publications visible to you, out of a total of 1579

Abstract

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Authors: D. Cardinale, G. Guaitoli, D. Tondi, R. Luciani, S. Henrich, O. M. H. Salo-Ahen, S. Ferrari, G. Marverti, D. Guerrieri, A. Ligabue, C. Frassineti, C. Pozzi, S. Mangani, D. Fessas, R. Guerrini, G. Ponterini, R. C. Wade, M. P. Costi

Date Published: 23rd Aug 2011

Publication Type: Journal

Abstract

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Authors: Vlad Cojocaru, Kia Balali-Mood, Mark S. P. Sansom, Rebecca C. Wade

Date Published: 11th Aug 2011

Publication Type: Journal

Abstract

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Authors: Georgi V. Pachov, Razif R. Gabdoulline, Rebecca C. Wade

Date Published: 1st Jul 2011

Publication Type: Journal

Abstract

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Authors: A. Pasquali, A. Bik, S. Zibetti, N. Ageorges, W. Seifert, W. Brandner, H.-W. Rix, M. Jütte, V. Knierim, P. Buschkamp, C. Feiz, H. Gemperlein, A. Germeroth, R. Hofmann, W. Laun, R. Lederer, M. Lehmitz, R. Lenzen, U. Mall, H. Mandel, P. Müller, V. Naranjo, K. Polsterer, A. Quirrenbach, L. Schäffner, C. Storz, P. Weiser

Date Published: 1st Apr 2011

Publication Type: Journal

Abstract (Expand)

The solubility in pure and saline water at various temperatures was calculated for selected nitro compounds (nitrobenzene, 1,3,5-trinitrobenzene, 2-nitrotoluene, 3-nitrotoluene, 4-nitrotoluene, 2,4-dinitrotoluene, 2,6-dinitrotoluene, 2,3-dinitrotoluene, 3,4-dinitrotoluene, 2,4,6-trinitrotoluene) using the Conductor-like Screening model for Real Solvents (COSMO-RS). The results obtained were compared with experimental values. The COSMO-RS predictions have shown high accuracy in reproducing the trends of aqueous solubilities for both temperature and salinity. The proposed methodology was then applied to predict the aqueous solubilities of 19 nitro compounds in the temperature range of 5–50 °C in saline solutions. The salting-out parameters of the Setschenow equation were also calculated. The predicted salting-out parameters were overestimated when compared to the measured values, but these parameters can still be used for qualitative estimation of the trends.

Authors: Yana A. Kholod, Ganna Gryn’ova, Leonid Gorb, Frances C. Hill, Jerzy Leszczynski

Date Published: 1st Apr 2011

Publication Type: Journal

Abstract

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Authors: Raman S. Sundar, R. Gopalakrishnan, R. C. Wade, V. Subramanian

Date Published: 24th Mar 2011

Publication Type: Journal

Abstract

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Authors: Daria B. Kokh, Rebecca C. Wade, Wolfgang Wenzel

Date Published: 1st Mar 2011

Publication Type: Journal

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