FS-SMP

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2019-08-13
14:24
OpenAccess [PUBDB-2019-03006] Journal Article
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Dispersion-controlled docking preference: multi-spectroscopic study on complexes of dibenzofuran with alcohols and water
The structural preferences within a series of dibenzofuran–solvent complexes have been investigated by electronic, vibrational, and rotational spectroscopic methods probing supersonic jet expansions. The experimental study is accompanied by a detailed theoretical analysis including dispersion-corrected density functional theory, symmetry adapted perturbation theory, as well as coupled cluster approaches [...]
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ddc:540
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2019-08-13
14:11
OpenAccess [PUBDB-2019-03004] Journal Article
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On the origin of the extremely different solubilities of polyethers in water
The solubilities of polyethers are surprisingly counter-intuitive. The best-known example is the difference between polyethylene glycol ([–CH$_2$–CH$_2$–O–]$_n$) which is infinitely soluble, and polyoxymethylene ([–CH$_2$–O–]$_n$) which is completely insoluble in water, exactly the opposite of what one expects from the C/O ratios of these molecules. [...]
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ddc:500
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2019-08-13
14:07
[PUBDB-2019-03003] Journal Article
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Water Docking Bias in [4]Helicene
We report on the one‐ and two‐water clusters of [4]helicene, the smallest polycyclic aromatic hydrocarbon with a helical sense, which were captured in the gas phase using high‐resolution rotational spectroscopy. The structures of the complexes are unambiguously revealed using microwave spectra of isotopically enriched species. [...]
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ddc:540
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2019-08-07
14:06
OpenAccess [PUBDB-2019-02928] Journal Article
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Rotational spectroscopy of imidazole: improved rest frequencies for astrophysical searches
Context. Organic ring compounds play a key role in terrestrial biochemistry, and they were also most likely pivotal ingredients in Earth’s prebiotic chemistry [...]
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ddc:520
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2019-06-26
09:41
OpenAccess [PUBDB-2019-02589] Journal Article
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Far-IR and UV spectral signatures of controlled complexation and microhydration of the polycyclic aromatic hydrocarbon acenaphthene
In this work we report on the experimental and theoretical investigations of the progressional complexation of the polycyclic aromatic hydrocarbon (PAH) acenaphthene with itself and with water. In the interstellar medium, PAH complexes are an important link between molecular gas and solid state configurations of carbon, and in the form of grains they are postulated to serve as chemical catalysts. [...]
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ddc:540
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2019-06-26
09:36
OpenAccess [PUBDB-2019-02588] Journal Article
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The structural determination and skeletal ring modes of tetrahydropyran
A high-resolution molecular spectroscopy study was carried out on the cyclic ether tetrahydropyran (THP), one of the smallest molecules composed of a pyranose ring. As this ring structure is closely related to carbohydrates, THP can offer relevant insight into structural variations of this unit. [...]
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ddc:540
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2019-05-14
14:52
[PUBDB-2019-02274] Lecture
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Molecular and Ultrafast Science Seminar (MUSS)
Lecture at Universität Hamburg (Hamburg, Germany), 1 Apr 2019 - 13 Jul 20192019-04-012019-07-13
CFEL Molecular and Ultrafast Science Seminar (MUSS) series. This is a general topical seminar series on developments in modern molecular and ultrafast science jointly organized by the CFEL Controlled Molecule Imaging group, the Spectroscopy of molecular processes group, the CFEL Attosecond Science group, and the CFEL Ultrafast Optics group. [...]
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2019-05-14
14:03
[PUBDB-2019-02269] Lecture
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CFEL Molecular and Ultrafast Science Seminar (MUSS)
Lecture at Universität Hamburg (), 15 Oct 2018 - 2 Feb 20192018-10-152019-02-02
CFEL Molecular and Ultrafast Science Seminar (MUSS) series. This is a general topical seminar series on developments in modern molecular physics organized by the CFEL Controlled Molecule Imaging group, the Spectroscopy of molecular processes group, the CFEL Attosecond Science group, and the CFEL Ultrafast Optics group. [...]
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2019-05-14
13:52
[PUBDB-2019-02268] Lecture/Internal Report

Seminar zur Molekülphysik / Molecular Physics Seminar
Lecture at Universität Hamburg (), 3 Apr 2018 - 16 Jul 20182018-04-032018-07-16
CFEL Molecular Physics seminar series. This is a general topical seminar series on developments in modern molecular physics organized by the CFEL-CMI group Controlled Molecule Imaging and the CFEL-MPSD group Structure and Dynamics of Cold and Controlled Molecules. [...]
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2019-04-16
14:40
[PUBDB-2019-01960] Journal Article
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Rotational Signatures of Dispersive Stacking in the Formation of Aromatic Dimers
Angewandte Chemie 131(10), 3140 - 3145 () [10.1002/ange.201812556]  GO
The aggregation of aromatic species is dictated by inter‐ and intramolecular forces. Not only is characterizing these forces in aromatic growth important for understanding grain formation in the interstellar medium, but it is also imperative to comprehend biological functions. [...]
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ddc:660
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