Application of quantum crystallography methods to detect relativistic effects in crystal structures with heavy elements.
2018/31/N/ST4/02141
Keywords
Descriptors
- ST4_1: Chemia fizyczna
- ST4_4: Struktura i architektura molekularna
- ST4_15: Chemia teoretyczna i obliczeniowa
Panel
ST4 – Chemistry: physical chemistry/chemical physics, theoretical chemistry, analytical chemistry, inorganic chemistry, organic chemistry, method development
Host institution
Uniwersytet Warszawski, Wydział Chemii
Voivodeship: mazowieckie
Principal investigator (from the host institution)
Number of co-investigators in the project: 2
Call
PRELUDIUM 16 – announced on 2018-09-14
- Amount awarded
- 70 000 PLN
- Project start date
- 2019-07-11
- Project end date
- 2021-07-10
- Project duration
- 24 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]
- Dysk twardy przenośny. Cost: 1 000 PLN
- Laptop z oprogramowaniem.. Cost: 5 500 PLN
Information in the final report
Publication in academic press/journals (1)
-
Relativistic Hirshfeld atom refinement of an organo-gold(I) compound
- Authors:
- Pawlędzio Sylwia, Malinska Maura, Woińska Magdalena, Wojciechowski Jakub, Andrade Malaspina Lorraine, Kleemiss Florian, Grabowsky Simon, Woźniak Krzysztof
- Academic press:
- IUCrJ (year: 2021, volume: 8, pages: 608-620), Publisher: IUCr
- Status:
- Published
- DOI:
- 10.1107/S2052252521004541 – link to the publication