J. Phys. Chem. C 118 (28), 15315 (2014). Temperature dependent phase stability from first-principles calculations A. Thore, M. Dahlqvist, B. Alling, and J.Rosen.

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DOI: 10.1063/1.5085281. A chalcogen-bonded complex H 3 N· · ·S=C=S formed by ammonia and carbon disulfide characterised by chirped-pulse, broadband microwave spectroscopy. Ground-state rotational spectra were observed for ten symmetric-top isotopologues H 3 N⋯S=C=S, H 3 N⋯ 34 S=C=S, H 3 N⋯S=C= 34 S, H 3 N⋯S= 13 C=S, H 3 15 N⋯S=C=S, H 3 15 N⋯ 34 S=C=S, H 3 15 N⋯S=C= 34 S, H 3

Chem. Chem. Phys. 23, 6448-6454 (2021) • Inorganics 9, 13 (2021) 2020 (25) • ChemPhysChem 21, 2701–2708 (2020 2015-04-21 Phys Chem Chem Phys 17 (41) 27588-27595 [2015-11-07; online 2015-10-02] Affiliated researcher Year 2013. PubMed DOI Crossref. Modeling catalytic promiscuity in the alkaline phosphatase superfamily.

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, Phys. Chem. Chem. Phys. , 2011, 13 , 21351-21361. Physical chemistry chemical physics : PCCP, 2018-12-05, Vol.2 (47), p.354-355 ;. Vetenskapligt  More than protection: the function of TiO 2 interlayers in hematite functionalized Si photoanodes.

Phys Chem Chem Phys. ISSN: 1463-9076 (Print) 1463-9084 (Online) Previous Journal: Journal of the autonomic nervous system Abbreviation. Next Journal: Microscopica acta.

Phys-Chem-Chem-Phys 0 points 1 point 2 points 27 days ago The winter is chilly but one just dresses in layers and enjoy the snow and cold! The summers can be rather hot and humid though: today, it's +26 °C with 67% humidity.

Chem. Phys., 2020,22, 16215-16223 https://doi.org/10.1039/D0CP02207A · Download PDF Article  The article was first published on 05 lis 2015.

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av MM Walz · 2019 · Citerat av 7 — Our results show that the inclusion of more realistic physics into a force field chemistry calculations are in general considered to provide.

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Chem. 104B, 4101-4110, (2000). 47. T. Wågberg, E. Nyeanchi, A. Soldatov, and B. Sundqvist.

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29 Mar 2018 The Max Planck Institute for Chemical Physics of Solids is dedicated to the discovery of new materials with unusual properties. To this end 

Both long-range corrected functionals and global hybrids are more accurate than local functionals for many ground-state properties, at least for systems that do not have high multireference character. Weng G , et al.

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Phys. 19 (16) 10427-10435 [2017-00-00; online 2017-00-00]. Swedish NMR Centre  Chem . Phys . och Oecon .

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