Projects funded by the NCN

Information on the principal investigator and host institution

Information of the project and the call

Keywords

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Theoretical modeling of the self-assembly of molecular nanostructures in adsorbed overlayers

2015/17/B/ST4/03616

Keywords:

adsorption self-assembly supramolecular networks computer simulations

Descriptors:

  • ST4_5: Analytical chemistry
  • ST4_15: Colloid chemistry
  • ST5_12: Methods of nanomaterials/materials synthesis

Panel:

ST4 - Chemistry: physical chemistry/chemical physics, theoretical chemistry, analytical chemistry, inorganic chemistry, organic chemistry, method development

Host institution :

Uniwersytet Marii Curie-Skłodowskiej, Wydział Chemii

woj. lubelskie

Other projects carried out by the institution 

Principal investigator (from the host institution):

dr hab. Paweł Szabelski 

Number of co-investigators in the project: 3

Call: OPUS 9 - announced on 2015-03-16

Amount awarded: 209 000 PLN

Project start date (Y-m-d): 2016-02-24

Project end date (Y-m-d): 2019-02-23

Project duration:: 36 months (the same as in the proposal)

Project status: Project settled

Project description

Download the project description in a pdf file

Note - project descriptions were prepared by the authors of the applications themselves and placed in the system in an unchanged form.

Equipment purchased [PL]

  1. Serwer obliczeniowy (20 000 PLN)

Information in the final report

  • Publication in academic press/journals (10)
  • Articles in post-conference publications (1)
  1. Dichotomous On-Surface Self-Assembly of Tripod Molecules with Anchor Like Interaction Pattern
    Authors:
    Paweł Szabelski, Wojciech Rżysko, Damian Nieckarz
    Academic press:
    Topics in Catalysis (rok: 2018, tom: 61, strony: 1218-1226), Wydawca: Springer
    Status:
    Published
    DOI:
    10.1007/s11244-018-0976-4 - link to the publication
  2. Modeling of the 2D Self-Assembly of Tripod-Shaped Functional Molecules with Patchy Interaction Centers
    Authors:
    Wojciech Rżysko, Damian Nieckarz, Paweł Szabelski
    Academic press:
    Adsorption (rok: 2019, tom: 25, strony: 75-85), Wydawca: Springer
    Status:
    Published
    DOI:
    10.1007/s10450-018-9993-7 - link to the publication
  3. Effect of BackbonAspect Ratio on the Surface-Confined Self-Assembly of Tetratopic Molecular Building Blocks
    Authors:
    Damian Nieckarz, Wojciech Rżysko, Valery Lutsyk, Jakub Lisiecki, Paweł Szabelski
    Academic press:
    Colloids and Surfaces A (rok: 2019, tom: 579, strony: 123632), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.colsurfa.2019.123632 - link to the publication
  4. On-surface Self-Assembly of Tetratopic Molecular Building Blocks
    Authors:
    Damian Nieckarz, Wojciech Rżysko, Paweł Szabelski
    Academic press:
    Physical Chemistry Chemical Physics (rok: 2018, tom: 20, strony: 23363-23377), Wydawca: Royal Society of Chemistry
    Status:
    Published
    DOI:
    10.1039/C8CP03820A - link to the publication
  5. Self-Assembly of Conformationally Flexible Molecules under 2D Confinement: Structural Analysis from Computer Simulations
    Authors:
    Damian Nieckarz, Paweł Szabelski
    Academic press:
    Chemical Communications (rok: 2018, tom: 54, strony: 8749-8752), Wydawca: Royal Society of Chemistry
    Status:
    Published
    DOI:
    10.1039/C8CC04272A - link to the publication
  6. Directing the Self-Assembly of Tripod Molecules on Solid Surfaces: A Monte Carlo Simulation Approach
    Authors:
    Paweł Szabelski, Wojciech Rżysko, Damian Nieckarz
    Academic press:
    The Journal of Physical Chemistry C (rok: 2016, tom: 120, strony: 13139–13147), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.jpcc.6b03842 - link to the publication
  7. Hierarchical Ordering in Adsorbed Overlayers of Chiral Tripod Molecules with Directional Interactions
    Authors:
    Wojciech Rżysko, Damian Nieckarz, Paweł Szabelski
    Academic press:
    The Journal of Physical Chemistry C (rok: 2017, tom: 121, strony: 410-420), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.jpcc.6b10710 - link to the publication
  8. Influence of Molecular Shape and Interaction Anisotropy on the Self-Assembly of Tripod Building Blocks on Solid Surfaces
    Authors:
    Paweł Szabelski, Damian Nieckarz, Wojciech Rżysko
    Academic press:
    Colloids and Surfaces A (rok: 2017, tom: 532, strony: 522-529), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.colsurfa.2017.04.009 - link to the publication
  9. Structure Formation in 2D Assemblies Comprising Functional Tripod Molecules With Reduced Symmetry
    Authors:
    Paweł Szabelski, Damian Nieckarz, Wojciech Rżysko
    Academic press:
    The Journal of Physical Chemistry C (rok: 2017, tom: 121, strony: 25104–25117), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.jpcc.7b06902 - link to the publication
  10. Surface-Confined Self-Assembly of Asymmetric Tetratopic Molecular Building Blocks
    Authors:
    Damian Nieckarz, Paweł Szabelski
    Academic press:
    ChemPhysChem (rok: 2019, tom: 20, strony: 1850-1859), Wydawca: Wiley
    Status:
    Published
    DOI:
    10.1002/cphc.201900344 - link to the publication
  1. Powstawanie hierarchicznych struktur supramolekularnych w wyniku samoorganizacji cząsteczek na powierzchniach ciał stałych - symulacje Monte Carlo
    Authors:
    Damian Nieckarz, Paweł Szabelski, Wojciech Rżysko
    Conference:
    Fizykochemia Granic Faz - Metody Instrumentalne (rok: 2018, ), Wydawca: Polskie Towarzystwo Chemiczne
    Data:
    konferencja 23-26.04.2017
    Status:
    Published

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