Projects funded by the NCN

Information on the principal investigator and host institution

Information of the project and the call

Keywords

Equipment

Delete all

Towards the (astro)chemistry of charged policyclic aromatic hydrocarbons.

2011/03/B/ST4/01351

Keywords:

extended red emission (ERE) charged policyclic aromatic hydrocarbons UV-VIS spectroscopic properties local aromaticity substituent effect

Descriptors:

  • ST4_15: Colloid chemistry
  • ST9_3: Interstellar medium

Panel:

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

Host institution :

Uniwersytet Łódzki, Wydział Chemii

woj. łódzkie

Other projects carried out by the institution 

Principal investigator (from the host institution):

dr hab. Marcin Palusiak 

Number of co-investigators in the project: 3

Call: OPUS 2 - announced on 2011-09-15

Amount awarded: 95 500 PLN

Project start date (Y-m-d): 2012-09-05

Project end date (Y-m-d): 2014-03-04

Project duration:: 18 months (the same as in the proposal)

Project status: Project settled

Equipment purchased [PL]

  1. wolnostojąca stacja obliczeniowa (19 800 PLN)
  2. notebook z oprogramowaniem i oprzyrządowaniem (8 496 PLN)
  3. serwer obliczeniowy typu rack (10 600 PLN)

Information in the final report

  • Publication in academic press/journals (5)
  1. Aromaticity from the viewpoint of molecular geometry: application to planar systems
    Authors:
    Tadeusz M. Krygowski, Halina Szatylowicz, Olga A. Stasyuk, Justyna Dominikowska, Marcin Palusiak
    Academic press:
    Chemical Reviews (rok: 2014, tom: 114, strony: 6383−6422), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/cr400252h - link to the publication
  2. The influence of substituent effect on noncovalent interactions in ternary complexes stabilized by hydrogen-bonding and halogen-bonding
    Authors:
    Małgorzata Domagała, Marcin Palusiak
    Academic press:
    Computational and Theoretical Chemistry (rok: 2014, tom: 1027, strony: 173-178), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.comptc.2013.11.007 - link to the publication
  3. Halogen–halogen interaction in view of many-body approach
    Authors:
    Justyna Dominikowska, Marcin Palusiak
    Academic press:
    Chemical Physics Letters (rok: 2013, tom: 583, strony: 45517), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.cplett.2013.07.055 - link to the publication
  4. Substituent effect on benzene dication
    Authors:
    Marcin Palusiak, Małgorzata Domagała, Justyna Dominikowska, F. Matthias Bickelhaupt
    Academic press:
    Physical Chemistry Chemical Physics (rok: 2014, tom: 16, strony: 4752-4763), Wydawca: Royal Society of Chemistry
    Status:
    Published
    DOI:
    10.1039/C3CP54089H - link to the publication
  5. UV-Vis spectra of singlet state cationic polycyclic aromatic hydrocarbons (time-dependent density functional theory study)
    Authors:
    Justyna Dominikowska, Malgorzata Domagała and Marcin Palusiak
    Academic press:
    Journal of Chemical Physics (rok: 2014, tom: 140, strony: 044324-1 - 044324-11), Wydawca: American Institute of Physics
    Status:
    Published
    DOI:
    10.1063/1.4862902 - link to the publication

O Narodowym Centrum Nauki

Finansowanie nauki

Współpraca zagraniczna

Centrum prasowe

Deklaracja dostępności
Przetwarzanie danych osobowych
Polityka cookies

Partnerzy