The Programme

9.00-10.30
10.30-11.15
11.15-11.45
Colloidal self-assembly-I
Chair: Arnout Imhof
Monday 10 February
Registration and coffee/tea
Julia Yeomans (University of Oxford)
Geert-Jan Kroes (LEI)
Charge transfer-I
Chair: Maxim Pchenitchnikov
General/catering
Plenary Session
Parallel Session
Theory & Method development
Chair: Paola Gori-Giorgi
11.50-12.10
Qing Pan
Spectroscopic studies on the
Tomislav Suhina
Press to turn on the light: surface contact intramolecular charge transfer dynamics:
the role of bridging ligands in the Ru/Pd
imaging with fluorescent probes
complexes
Riccardo Guareschi
Excited-state geometry optimization in
gas phase and in solution with quantum
Monte Carlo
12.10-12.30
Simone Dussi
Understanding the microscopic origin of
the macroscopic chirality in colloidal
liquid crystals
A. Mirtschink
Derivative Discontinuity in the StrongInteraction Limit of Density-Functional
Theory
12.30-12.50
Oleg Kozlov
Marlous Kamp
Mirko Franchini
Patchy silica/titania composite particles: Novel Star-Shaped Conjugated Molecules New fitting and integration techniques to
for Organic Photovoltaics
towards directional colloidal interactions
increase the precision of DFT calculations.
Anna Stradomska
Excited state dynamics in self-assembled
porphyrin nanotubes
Lunch & put up posters
12.50-14.00
Reversible Aggregation and
Adsorption
Chair: Klaas Besseling
Crystallization
Chair: Rene de Gelder
Computational Dynamics
Chair: Francesco Buda
14.00-14.20
Alexander V. Korobko
Phase Diagram for Solutions of
Interacting Living Polymers Confined by
Two Surfaces
Guowei Li
Magnetization, Electrical Transport
Properties and Electrochemical
Performance of High Purity Greigite
(Fe3S4)
L.J. Karssemeijer
Long timescale dynamics of adsorbed CO
on water ice surfaces
14.20-14.40
Aatish Kumar
Hybrid molecular dynamics simulation of
the formation of finite clusters of
telechelic polymers
Sjoerd Veldhuis
Reaction Mechanism of the Direct
Formation of Nano-crystalline BaTiO3 at
Room Temperature
Emanuela Negro
Coarse Grain Simulations of Dense
Bicontinuos Microemulsions Systems
14.40-15.00
Hélène Monteillet
Ultrastrong anchoring yet barrier-free
adsorption of composite microgels at
various liquid-liquid interfaces
Laura Spix
Formation of a salt enables complete
deracemisation of a racemic compound
through Viedma ripening
Ariana Torres KNoop
A Comparison of Advanced Monte Carlo
Methods for Open Systems: CFMC vs.
CBMC
Nanoparticles and Quantumdots-I
Chair: Ben Erne
Coffee/tea break
Advanced Spectroscopy
Chair: Anouk Rijs
DFT
Chair: Oleg Gritsenko
15.00-15.15
15.15-15.35
C. Boelsma
Verification of the Enthalpy Enthalpy
Compensation effect
Ole Brauckmann
The development of solid-state NMR
methodologies and their application to
aramids
Robert van Meer
Electronic excitations along the bond
dissociation coordinate with timedependent density MATRIX functional
theory
J. R. Mulder
Computational Design of NIR Dyes:
Substituent Effects on Photophysical
Absorption Properties
15.35-15.55
Saumyakanti Khatua
Suwarno
Resonant plasmonic enhancement of
The size dependence of sorption kinetics
single-molecule fluorescence by single gold
for carbon-supported MgH2 particles
nanorods
15.55-16.15
Bin Yan
Naveen Kumar
Conformation selective IR spectroscopy to
Andrii Rudavskyi
Morphology and interactions of
probe molecular structure and
Analysis of the spin-crossover mechanism
adsorbing kaolinite nanoparticles studied
interactions: SH∙∙∙O and OH∙∙∙O hydrogen
in Fe(II) complexes
with high resolution AFM
bond strengths in peptides
16.15-17.00
17.00-18.00
18.00-18.30
18.30-20.00
20.00-22.00
Talent workshop NWO
Get together
Jasper van der Gucht (WUR)
Dinner
Poster Session ODD (with drinks)
8.00-9.00
9.00-9.45
9.45-10.15
10.15-10.30
Colloidal self-assembly-II
Chair: Ilja Voets
10.30-10.50
Joost R. Wolters
Shape dependent self-assembly of
anisotropic particles with a tuneable
sticky patch
10.50-11.10
J.M. Meijer
Self-Assembly of Colloidal Hematite
Cubes: From Ordered Layers to Single
Crystals
11.10-11.30
Tuesday 11 February
Breakfast
Stefan Grimme (University of Bonn)
Herma Cuppen (RUN)
Coffee/tea break
Energy
Chair: Erik Kelder
Prasenjit Roy
Origin of giant magnetocaloric Effect
Meeting projectleaders
General/catering
Plenary Session
Parallel Session
Poster Session
Charge transfer-II
Chair: Ferdinand Grozema
Adriano Monti
In silico design of molecular triad for
efficient unidirectional charge separation
Fatemeh Mirjani
Clotilde le Quiniou
Optimizing the efficiency of singlet fission Excitation energy transfer and trapping in
in Perylenediimide (PDI) derivatives by
PSI supercomplexes of the green alga
crystal engineering
Chlamydomonas reinhardtii
Isja de Feijter
Francesca Costanzo
Michiel Aerts
Introducing supramolecular binding
The catalytic effect of carbon surfaces on Efficient carrier multiplication in colloidal
moieties to modulate mesoscale colloidal
H2 dissociation on Aln clusters by DFT
PbS nanosheets
self-assembly
11.30-11.45
11.45-12.30
Maarten de Zwart
Public-private Partnerships in Chemistry:
Funding Opportunities in the NWO Fund
New Chemical Innovations
postersession EVEN & Lunch (from 12:30)
12.30-13.30
Nanoparticles and Quantumdots-II
Chair: Gertjan Koster
Biomaterials
Chair: Joost Bakker
Sorption and scattering of molecules
Chair: Ger Koper
13.30-13.50
Petra Dral
The application of nanosheets as seed
layer for oriented film growth and film
transfer
Dr M. Huber
Structure of flexible regions in proteins:
The N-terminus of the antenna protein
CP29
Soledad van Eijk
Sorption mechanism for CO2 and water
on (K-promoted) hydrotalcites
13.50-14.10
A. Anastasopol
Reduced enthalpy of formation for
Mg/TiHx nanocomposites produced by
spark discharge generation
Xuan Qi Li,
Mark Wijzenbroek
Bio-inspired composites: close simulation The effect of the exchange-correlation
of a biomineralization process
functional on H2 dissociation on Ru(0001)
14.10-14.30
Yadan Ding
Towards sensitive biological detection
with fiber modified by nanotechnology
Caner Ünlü
Reorganization of the photosynthetic
membrane in gree algae in order to cope
with changing light conditions. A
picosecond fluorescence spectroscopy
study
14.30-14.45
14.45-15.30
15.30-15.45
Poster Session
Coffee/tea break & take down posters
Henry Chapman (CFEL)
Poster award + closing
Jolijn Onvlee
Molecular Collisions Coming into Focus

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