Publications 2018


Showing entries 0 - 20 out of 109

Shi L, Wei J, Yanagi K, Saito T, Cao K, Kaiser U et al. Templated direct growth of ultra-thin double-walled carbon nanotubes. Nanoscale. 2018 Nov 5. Available from, DOI: 10.1039/C8NR06925E


Brand C, Stickler BA, Knobloch C, Shayeghi A, Hornberger K, Arndt M. Conformer Selection by Matter-Wave Interference. Physical Review Letters. 2018 Oct 23;121(17). 173002. Available from, DOI: 10.1103/PhysRevLett.121.173002


Holzer C, Gui X, Harding ME, Kresse G, Helgaker T, Klopper W. Bethe-Salpeter correlation energies of atoms and molecules. Journal of Chemical Physics. 2018 Oct 14;149(14). 144106. Available from, DOI: 10.1063/1.5047030


DeHaven BA, Goodlett DW, Sindt AJ, Noll N, De Vetta M, Smith MD et al. Enhancing the Stability of Photogenerated Benzophenone Triplet Radical Pairs through Supramolecular Assembly. Journal of the American Chemical Society. 2018 Oct 10;140(40):13064-13070. Available from, DOI: 10.1021/jacs.8b08501


Hofer C, Kramberger C, Monazam MRA, Mangler C, Mittelberger A, Argentero G et al. Revealing the 3D structure of graphene defects. 2D Materials. 2018 Oct;5(4). 045029. Available from, DOI: 10.1088/2053-1583/aaded7


Talotta F, Boggio-Pasqua M, Gonzalez L. SHARC Photodynamics of the TRANS-[RuCl(NO)Py4]2+. 2018. Poster session presented at 54th Symposium on Theoretical Chemistry (STC 2018), Halle (Saale), Germany.


Riva M, Kubicek M, Hao X, Franceschi G, Gerhold S, Schmid M et al. Influence of surface atomic structure demonstrated on oxygen incorporation mechanism at a model perovskite oxide. Nature Communications. 2018 Sep 13;9. 3710. Available from, DOI: 10.1038/s41467-018-05685-5


Heeg S, Shi L, Poulikakos LV, Pichler T, Novotny L. Carbon nanotube chirality determines properties of encapsulated linear carbon chain. Nano Letters. 2018 Sep 12;18(9):5426–5431. Available from, DOI: 10.1021/acs.nanolett.8b01681


Lahnsteiner J, Kresse G, Bokdam M. Finite temperature structure of hybrid perovskites from ab-initio and classical MD. 2018. Poster session presented at International Workshop on Computational Design and Discovery of Novel Materials, Lausanne, Switzerland.


Sánchez Murcia PA, Nogueira Perez JJ, Plasser F, Gonzalez L. Quantification of directional excitations in Ru-based photosensitizers using orbital-free theoretical descriptors. 2018. Poster session presented at Quantum Bio•Inorganic Chemistry IV (QBIC•IV), Bath, United Kingdom.


Showing entries 0 - 20 out of 109