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EPFL  >  SB  >  ISIC > Research Units > Laboratory of The... > Research area
SUMMARY
CONTACT

Prof. Jiri VANICEK

Ecole polytechnique fédérale de Lausanne
Institut des sciences et ingénierie chimiques
EPFL SB ISIC LCPT
BCH 3110 (Bât. BCH)
CH-1015 Lausanne

Office: BCH 3110

T: +41 (0)21 693 47 36
F: +41 (0)21 693 97 55

Secretary:

Kathryn Aitken MAULAZ
T: +41 (0)21 693 47 23
F: +41 (0)21 693 97 55

Office: BCH 3109


RESEARCH AREA

Quantum and classical molecular dynamics

efficient evaluation of accuracy of quantum molecular dynamics [14]

 

Thermodynamics and quantum statistical physics

equilibrium isotope effects [15]

 

Statistical biophysics and bioinformatics

prediction of genes regulated by microRNAs [13]

 

Chemical kinetics

kinetic isotope effects [9,10,12]

deviations from Arrhenius equation due to quantum effects

 

Semiclassical approximations

replacement manifolds [2,3,4,6], dephasing representation [5,7,8,11]

 

Development of efficient computational methods

efficient estimators in path integral Monte Carlo and path integral molecular dynamics [10,12,15]

trajectory based methods for quantum dynamics [7,8,11,14]

 

Decoherence and quantum fidelity

dephasing representation of quantum fidelity [7,8,11]

 

Nonlinear dynamics and quantum chaos


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