Projects funded by the NCN

Information on the principal investigator and host institution

Information of the project and the call

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Towards an understanding the nature of environmental release and exposure of nanoparticles

2012/07/D/NZ7/04342

Keywords:

nanomatrials theoretical chemistry QSPR enviromental exposure LCA

Descriptors:

  • NZ7_2: Environment and health risks
  • ST4_15: Colloid chemistry
  • ST4_2: Spectroscopic and spectrometric techniques

Panel:

NZ7 - Diagnostic tools, therapies and public health: public health, epidemiology, environmental health risks and occupational medicine, medical ethics, drug discovery and therapies, pharmacology

Host institution :

Uniwersytet Gdański, Wydział Chemii

woj. pomorskie

Other projects carried out by the institution 

Principal investigator (from the host institution):

dr Celina Sikorska 

Number of co-investigators in the project: 3

Call: SONATA 4 - announced on 2012-09-15

Amount awarded: 468 832 PLN

Project start date (Y-m-d): 2013-09-30

Project end date (Y-m-d): 2018-04-29

Project duration:: 55 months (the same as in the proposal)

Project status: Project settled

Information in the final report

  • Publication in academic press/journals (8)
  • Articles in post-conference publications (1)
  1. Mg3F7: a superhalogen with potential for new nanomaterials design
    Authors:
    Celina Sikorska
    Academic press:
    International Journal of Quantum Chemistry (rok: 2018, tom: 118, strony: art. no. e25728), Wydawca: Wiley
    Status:
    Published
    DOI:
    10.1002/qua.25728 - link to the publication
  2. Combined quantum-mechanical and chemometric approach supporting the design of fullerene derivative acceptors for solar cells
    Authors:
    Celina Sikorska, Agnieszka Lipska
    Academic press:
    Environmental Science & Technology (rok: 2018, ), Wydawca: American Chemical Society
    Status:
    Submitted
    DOI:
    brak - link to the publication
  3. Efficient way of designing fullerene derivatives based on simplified DFT calculations and QSPR modeling
    Authors:
    Celina Sikorska, Agnieszka Gajewicz, Piotr Urbaszek, Łukasz Lubiński, Tomasz Puzyn
    Academic press:
    Chemometrics and Intelligent Laboratory Systems (rok: 2016, tom: 152, strony: 125–133), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.chemolab.2016.02.003 - link to the publication
  4. Oxidizing Metal Oxides with Polynuclear Superhalogen: An ab Initio Study
    Authors:
    Celina Sikorska
    Academic press:
    Journal of Physical Chemistry A (rok: 2018, tom: 122, strony: 7328−7338), Wydawca: ACS Publications
    Status:
    Published
    DOI:
    10.1021/acs.jpca.8b05095 - link to the publication
  5. Helical multi-walled carbon nanotubes as an efficient material for the dispersive solid-phase extraction of low and high molecular weight polycyclic aromatic hydrocarbons from water samples: theoretical study
    Authors:
    Monika Paszkiewicz, Celina Sikorska, Danuta Leszczyńska, Piotr Stepnowski
    Academic press:
    Water, Air, & Soil Pollution (rok: 2018, tom: 229, strony: art. no. 253), Wydawca: Springer
    Status:
    Published
    DOI:
    10.1007/s11270-018-3884-0 - link to the publication
  6. When a nanoparticle meets a superhalogen: a case study with C60 fullerene
    Authors:
    Celina Sikorska
    Academic press:
    Physical Chemistry Chemical Physics (rok: 2016, tom: 18, strony: 18739-18749), Wydawca: The Royal Society of Chemistry
    Status:
    Published
    DOI:
    10.1039/c6cp00380j - link to the publication
  7. Development of a novel in silico model of zeta potential for metal oxide nanoparticles: a nano-QSPR approach
    Authors:
    Ewelina Wyrzykowska, Alicja Mikołajczyk, Celina Sikorska, Tomasz Puzyn
    Academic press:
    Nanotechnology (rok: 2016, tom: 27, strony: Article Number: 445702 (s.1-8)), Wydawca: IOP Publishing LTD
    Status:
    Published
    DOI:
    10.1088/0957-4484/27/44/445702 - link to the publication
  8. Overview of experimental and computational methods for the determination of the pKa values of 5-fluorouracil, cyclophosphamide, ifosfamide, imatinib and methotrexate
    Authors:
    Katarzyna Mioduszewska, Joanna Dołżonek, Dariusz Wyrzykowski, Łukasz Kubik, Paweł Wiczling, Celina Sikorska, Michał Toński, Zbigniew Kaczyński, Piotr Stepnowski, Anna Białk-Bielińska
    Academic press:
    Trends in Analytical Chemistry (rok: 2017, tom: 97, strony: 283-296), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.trac.2017.09.009 - link to the publication
  1. Efficient Chemometric Approach Supporting the Design of Fullerene Derivatives for Solar Cells
    Authors:
    Celina Sikorska
    Conference:
    3rd World Congress on Recent Advances in Nanotechnology (RAN'18) (rok: 2018, ), Wydawca: International ASET
    Data:
    konferencja 10-12 kwietnia 2018
    Status:
    Published

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