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COSMOlogic team member:

Dr. Uwe Huniar

Contact:
Dr. Uwe Huniar
COSMOlogic GmbH & Co. KG
Burscheider Str. 515
D-51381 Leverkusen
Germany

Phone: +49-2171-36366-5
FAX: +49-2171-73168-9

EMail: huniar@cosmologic.de

News/Announcements

Meet COSMOlogic at these conferences next time.

*** Free Fluid-Phase-Thermodynamics and COSMO-RS Course
October 2012 (8. - 12.10.), University of Regensburg +++ Please sign in for Regensburg lecture +++

Next COSMOtherm training
March 2012, 6th
at COSMOlogic
Next TURBOMOLE training
February 10th, 2011
at COSMOlogic

Next COSMO-RS Symposium in 2013 - Questionaire

December 2011

COSMOtherm Version C3.0 Revision 12.01 released Release Notes

Publication on hydrogen bond energy prediction by using sigma.

September 2011

Publication on the prediction of polyether-water mixtures

July 2011

COSMOfrag Version 3.3, see Release Notes

COSMOtherm as a Valuable Tool for Cocrystal Screening and Development pdf

TmoleX 3.2 Client
download for free

June 2011

New COSMO and COSMO-RS review has appeared
and is temporarily freely available

May 2011

New cooperation with Prof. Steven Abbott, TCNF

March 2011

TURBOMOLE 6.3 released

November 2010

COSMOtherm is Champion of the Sixth Industrial Fluid Properties Simulation Challenge 2010

October 2010

TmoleX - A graphical user interface for TURBOMOLE Journal of Computational Chemistry
Volume 31, Dec 2010

September 2010

Modelling cellulose solubilities in ionic liquids using COSMO-RS

August 2010

COSMOtherm yields more accurate activity coefficients than UNIFAC and COSMO-SAC on recently published reference data.

May 2010

COSMOtherm yielded the most accurate blind predictions of the hydration free energies ...more

COSMOtherm Application by BASF Prediction of absolute rate constants for a polymerization reaction in solution.

March 2010

COSMO-RS Article: "Towards a first principles prediction of pKa: COSMO-RS and the cluster-continuum approach."

COSMOmic released!

February 2010

A Case Study in the Pre-Calculation of Henry Coefficients in Chemical Engineering & Technology
COSMO-RS among the best!

January 2010

A new review of COSMO-RS appeared in the first issue of Annual Reviews of Chemical Biochemical Engineering

COSMOtherm in environmental science: correct pKa prediction of PFOA. (PDF)

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