Publications

Showing entries 681 - 700 out of 1283

2018

Bethe-Salpeter correlation energies of atoms and molecules. / Holzer, Christof; Gui, Xin; Harding, Michael E. et al.
In: Journal of Chemical Physics, Vol. 149, No. 14, 144106, 14.10.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Enhancing the Stability of Photogenerated Benzophenone Triplet Radical Pairs through Supramolecular Assembly. / DeHaven, Baillie A.; Goodlett, Dustin W.; Sindt, Ammon J. et al.
In: Journal of the American Chemical Society, Vol. 140, No. 40, 10.10.2018, p. 13064-13070.

Publications: Contribution to journal › Article › Peer Reviewed

Cycle stability and hydration behavior of magnesium oxide and its dependence on the precursor-related particle morphology. / Gravogl, Georg; Knoll, Christian; Welch, Jan M. et al.
In: Nanomaterials, Vol. 8, No. 10, 795, 07.10.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Ab initio phase diagram of PbSe crystals calculated with the random phase approximation. / Schaefer, Tobias (Corresponding author); Fan, Zhaochuan; Grünwald, Michael et al.
In: Physical Review B, Vol. 98, No. 14, 144103, 03.10.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Revealing the 3D structure of graphene defects. / Hofer, Christoph; Kramberger, Christian; Monazam, Mohammad Reza Ahmadpour et al.
In: 2D Materials, Vol. 5, No. 4, 045029, 10.2018.

Publications: Contribution to journal › Article › Peer Reviewed

2D Material Science: Defect Engineering by Particle Irradiation. / Schleberger, Marika (Corresponding author); Kotakoski, Jani.
In: Materials - Open Access Journal, Vol. 11, No. 10, 1885, 10.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Ab initio study of ABiO(3) (A = Ba, Sr, Ca) under high pressure. / Smolyanyuk, Andriy (Corresponding author); Franchini, Cesare; Boeri, Lilia.
In: Physical Review B, Vol. 98, No. 11, 115158, 27.09.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Effects of Contact Angle and Flocculation of Particles of Oligomer of Tetrafluoroethylene on Oil Foaming. / Murakami, Ryo (Corresponding author); Kobayashi, Syuji; Okazaki, Manami et al.
In: Frontiers in Chemistry, Vol. 6, 435, 24.09.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Correlated excited states in the narrow band gap semiconductor FeSi and antiferromagnetic screening of local spin moments. / Khmelevskyi, Sergii (Corresponding author); Kresse, Georg; Mohn, Peter.
In: Physical Review B, Vol. 98, No. 12, 125205, 20.09.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Influence of surface atomic structure demonstrated on oxygen incorporation mechanism at a model perovskite oxide. / Riva, Michele; Kubicek, Markus; Hao, Xianfeng et al.
In: Nature Communications, Vol. 9, No. 1, 3710, 13.09.2018.

Publications: Contribution to journal › Article › Peer Reviewed

Carbon nanotube chirality determines properties of encapsulated linear carbon chain. / Heeg, Sebastian; Shi, Lei; Poulikakos, Lisa V. et al.
In: Nano Letters, Vol. 18, No. 9, 12.09.2018, p. 5426–5431.

Publications: Contribution to journal › Article › Peer Reviewed

Improving the multifunctional behaviour of structural supercapacitors by incorporating chemically activated carbon fibres and mesoporous silica particles as reinforcement. / Javaid, A. (Corresponding author); Ho, K. K.C.; Bismarck, A. et al.
In: Journal of Composite Materials, Vol. 52, No. 22, 01.09.2018, p. 3085-3097.

Publications: Contribution to journal › Article › Peer Reviewed

Continuous carbon nanotube synthesis on charged carbon fibers. / Anthony, David B.; Sui, XiaoMeng; Kellersztein, Israel et al.
In: Composites Part A: Applied Science and Manufacturing, Vol. 112, 09.2018, p. 525-538.

Publications: Contribution to journal › Article › Peer Reviewed

Fermi level engineering of metallicity-sorted metallic single-walled carbon nanotubes by encapsulation of few-atom-thick crystals of silver chloride. / Kharlamova, Marianna V. (Corresponding author); Kramberger, Christian; Domanov, Oleg et al.
In: Journal of Materials Science, Vol. 53, No. 18, 09.2018, p. 13018-13029.

Publications: Contribution to journal › Article › Peer Reviewed

Intersystem Crossing as a Key Component of the Nonadiabatic Relaxation Dynamics of Bithiophene and Terthiophene. / Schnappinger, Thomas; Marazzi, Marco; Mai, Sebastian et al.
In: Journal of Chemical Theory and Computation, Vol. 14, No. 9, 09.2018, p. 4530-4540.

Publications: Contribution to journal › Article › Peer Reviewed

CHAPTER 10: General Trajectory Surface Hopping Method for Ultrafast Nonadiabatic Dynamics. / Mai, Sebastian; Plasser, Felix; Marquetand, Philipp et al.
Attosecond Molecular Dynamics . ed. / Franck Lepine; Marc J. J. Vrakking. 13. ed. Royal Society of Chemistry, 2018. p. 348-385 (RSC Theoretical and Computational Chemistry Series; No. 13, Vol. 2018-January).

Publications: Contribution to book › Chapter › Peer Reviewed

Atomic-Scale Deformations at the Interface of a Mixed-Dimensional van der Waals Heterostructure. / Mustonen, Kimmo (Corresponding author); Hussain, Aqeel; Hofer, Christoph et al.
In: ACS Nano, Vol. 12, No. 8, 28.08.2018, p. 8512–8519.

Publications: Contribution to journal › Article › Peer Reviewed

Atomic-Scale in Situ Observations of Crystallization and Restructuring Processes in Two-Dimensional MoS2 Films. / Bayer, Bernhard C. (Corresponding author); Kaindl, Reinhard; Reza Ahmadpour Monazam, Mohammad et al.
In: ACS Nano, Vol. 12, No. 8, 28.08.2018, p. 8758–8769.

Publications: Contribution to journal › Article › Peer Reviewed

Extraction of Linear Carbon Chains Unravels the Role of the Carbon Nanotube Host. / Shi, Lei; Yanagi, Kazuhiro; Cao, Kecheng et al.
In: ACS Nano, Vol. 12, No. 8, 28.08.2018, p. 8477–8484.

Publications: Contribution to journal › Article › Peer Reviewed

Any good? Foam templating as route for tailor-made macroporous polymer foams. / Jalalian, Mohammad; Jiang, Qixiang; Bismarck, Alexander.
In: American Chemical Society. Abstracts of Papers (at the National Meeting), Vol. 256, 19.08.2018.

Publications: Contribution to journal › Meeting abstract/Conference paper › Peer Reviewed

Showing entries 681 - 700 out of 1283