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Category:  Main » Science » Chemistry » Computational » Research Groups

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Truhlar, Donald G. Popularity:    Hit: 56
Details:
Potential energy surfaces for chemical reaction dynamics; transition state theory with an emphasis on isotope effects and tunneling corrections.

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URL: http://comp.chem.umn.edu/truhlar/
Title: Donald G. Truhlar
Description: Science, Chemistry, Computational, Research Groups - Truhlar, Donald G.. Potential energy surfaces for chemical reaction dynamics
Specialized in:

 
Theoretical Chemistry Division, Royal Institute of Technology (KTH), Sweden (Popularity: ): Ab initio quantum chemistry, molecular response properties, and nonlinear optical properties.
Theoretical Chemistry Group, University of Oslo (Popularity: ): Ab initio quantum chemistry, molecular response properties, and explicitly correlated electronic wavefunctions.
Computational Chemistry Group, U.S. National Institute of Standards and Technology (NIST) (Popularity: ): Ab initio quantum chemistry and computational thermochemistry.
First Principles Research (Popularity: ): Ab initio quantum chemistry and computational studies of superconductors.
Cambridge Centre for Computational Chemistry (Popularity: ): Condensed matter science, surface science and statistical mechanics of complex and disordered systems.
Schlegel Group (Popularity: ): Computational chemistry.
Baik Group (Popularity: ): Computational chemistry and molecular modeling.
Molecular Modeling Heidelberg (Popularity: ): Offers a number of free online services; focus is on carbohydrates.
Drug Design Laboratory, Milan University (Popularity: ): Molecular modeling resources, software and projects. Home of the programs Vega and BioDock.
Cramer, Christopher J. (Popularity: ): Ab initio and density functional quantum chemistry with a particular focus on biomolecules, solvation phenomena, and atomic partial charges.


Popular Sites
Carter, Emily A. (Popularity: ): Ab initio quantum chemistry and ab initio molecular dynamics, with an emphasis on condensed phases (UCLA).
Theoretical Chemistry Group, University of Oslo (Popularity: ): Ab initio quantum chemistry, molecular response properties, and explicitly correlated electronic wavefunctions.
Cambridge Centre for Computational Chemistry (Popularity: ): Condensed matter science, surface science and statistical mechanics of complex and disordered systems.
Handy, Nicholas (Popularity: ): Ab initio and density functional quantum chemistry with an emphasis on development of new density functionals (Cambridge University).
Computational Chemistry Group, U.S. National Institute of Standards and Technology (NIST) (Popularity: ): Ab initio quantum chemistry and computational thermochemistry.


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