Journal Article GSI-2022-00869

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Reactivity of Group 13 Elements Tl and Element 113, Nh, and of Their Hydroxides with Respect to Various Quartz Surfaces from Periodic Relativistic DFT Calculations

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2022
American Chemical Society Washington, DC

Inorganic chemistry 61(40), 15910 - 15920 () [10.1021/acs.inorgchem.2c02103]

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Note: The authors are thankful to experimentalists working in this area, R. Eichler (PSI, Switzerland), P. Steinegger (PSI, Switzerland), A. Yakushev (GSI, Darmstadt), and Ch. E. Düllmann (GSI, Darmstadt), for valuable discussions of the experimental results. M.I. thanks the HIM for the financial support through the Visiting Scholar Agreement, the support of the Slovak Research and Development Agency (APVV-20-0098), and the Scientific Grant Agency (VEGA 1/0562/20 and VEGA 1/0550/23). This work was partially supported by the grant of Ministry of Science and Higher Education of the Russian Federation, 075-10-2020-117.

Contributing Institute(s):
  1. SHE Chemie (SHC)
  2. HIM / SHE (MSH)
Research Program(s):
  1. 612 - Cosmic Matter in the Laboratory (POF4-612) (POF4-612)
Experiment(s):
  1. no experiment theory work (POF3; theory)

Appears in the scientific report 2022
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 Record created 2022-11-29, last modified 2023-10-15