Personal Information
Organización/Lugar de trabajo
Girona, Spain Spain
Ocupación
ICREA Research Professor
Sector
Education
Sitio web
www.marcelswart.eu
Acerca de
My current research position at the Institut de Química Computacional i Catàlisi (IQCC) at the Universitat de Girona (UdG) has been made possible by the "Institució Catalana de Recerca i Estudis Avançats" (ICREA).
Research interests
I am interested in Understanding and controlling chemical environment effects through the application of computational and theoretical chemistry methodologies.
Specialties: Density Functional Theory, polarizable force fields, bioinorganic and organic chemistry, multi-level (QM/MM or QM/QM) approaches, molecular simulations.
Etiquetas
taste receptors
respiration
reaction barriers
chemistry
girona
fullerenes
photosynthesis
exafs
x-ray
epr
xas
collaboration
dft
nmr
mössbauer
cost
spin states
Ver más
Presentaciones
(2)Personal Information
Organización/Lugar de trabajo
Girona, Spain Spain
Ocupación
ICREA Research Professor
Sector
Education
Sitio web
www.marcelswart.eu
Acerca de
My current research position at the Institut de Química Computacional i Catàlisi (IQCC) at the Universitat de Girona (UdG) has been made possible by the "Institució Catalana de Recerca i Estudis Avançats" (ICREA).
Research interests
I am interested in Understanding and controlling chemical environment effects through the application of computational and theoretical chemistry methodologies.
Specialties: Density Functional Theory, polarizable force fields, bioinorganic and organic chemistry, multi-level (QM/MM or QM/QM) approaches, molecular simulations.
Etiquetas
taste receptors
respiration
reaction barriers
chemistry
girona
fullerenes
photosynthesis
exafs
x-ray
epr
xas
collaboration
dft
nmr
mössbauer
cost
spin states
Ver más