Publications 2017


Showing entries 0 - 20 out of 134

The cohesive energy of superheavy element copernicium determined from accurate relativistic coupled-cluster theory. / Steenbergen, K. G.; Mewes, J-M.; Pasteka, L. F.; Gaggeler, H. W.; Kresse, G.; Pahl, E.; Schwerdtfeger, P. (Corresponding author).

In: Physical Chemistry Chemical Physics - PCCP, Vol. 19, No. 48, 28.12.2017, p. 32286-32295.

Research output: Contribution to journalArticle


Nanoparticle detection in an open-access silicon microcavity. / Kuhn, Stefan (Corresponding author); Wachter, Georg; Wieser, Franz-Ferdinand; Millen, James; Schneider, Michael; Schalko, Johannes; Schmid, Ulrich; Trupke, Michael; Arndt, Markus.

In: Applied Physics Letters, Vol. 111, No. 25, 253107, 18.12.2017.

Research output: Contribution to journalArticle


Electronic band gaps of confined linear carbon chains ranging from polyyne to carbyne. / Shi, Lei; Rohringer, Philip; Wanko, Marius; Rubio, Angel; Waßerroth, Sören; Reich, Stephanie; Cambré, Sofie; Wenseleers, Wim; Ayala, Paola; Pichler, Thomas.

In: Physical Review Materials, Vol. 1, 075601, 12.12.2017.

Research output: Contribution to journalArticle


Fast and slow dynamics in rare events – The disk-to-slab transition in the 2d Ising model. / Moritz, Clemens; Dellago, Christoph.

2017. Poster session presented at Recent Andvances in Modelling Rare Events, Agra, India.

Research output: Contribution to conferencePoster


Topology-Sensitive Microfluidic Filter for Polymers of Varying Stiffness. / Weiß, Lisa; Nikoubashman, Arash; Likos, Christos.

In: ACS Macro Letters, Vol. 6, No. 12, 05.12.2017, p. 1426-1431.

Research output: Contribution to journalArticle


Computational insights and the observation of SiC nanograin assembly: towards 2D silicon carbide. / Susi, Toma (Corresponding author); Skákalová, Viera; Mittelberger, Andreas; Kotrusz, Peter; Hulman, Martin; Pennycook, Timothy J.; Mangler, Clemens; Kotakoski, Jani; Meyer, Jannik C. (Corresponding author).

In: Scientific Reports, Vol. 7, No. 1, 4399, 01.12.2017.

Research output: Contribution to journalArticle


The role of directional interactions in the designability of generalized heteropolymers. / Cardelli, Chiara; Bianco, Valentino; Rovigatti, Lorenzo; Nerattini, Francesca; Tubiana, Luca; Dellago, Christoph; Coluzza, Ivan (Corresponding author).

In: Scientific Reports, Vol. 7, No. 1, 4986, 01.12.2017.

Research output: Contribution to journalArticle


Direct measurement of Kramers turnover with a levitated nanoparticle. / Rondin, Loic; Gieseler, Jan; Ricci, Francesco; Quidant, Romain; Dellago, Christoph; Novotny, Lukas (Corresponding author).

In: Nature Nanotechnology, Vol. 12, No. 12, 12.2017, p. 1130-1133.

Research output: Contribution to journalArticle


Progress in electronics and photonics with nanomaterials. / Mishra, Y. K.; Murugan, N. A.; Kotakoski, J.; Adam, J.

In: Vacuum, Vol. 146, 12.2017, p. 304-307.

Research output: Contribution to journalEditorial


Exploring the Formation of Black Phosphorus Intercalation Compounds with Alkali Metals. / Abellan, Gonzalo; Neiss, Christian; Lloret, Vicent; Wild, Stefan; Chacon-Torres, Julio C.; Werbach, Katharina; Fedi, Filippo; Shiozawa, Hidetsugu; Goerling, Andreas; Peterlik, Herwig; Pichler, Thomas; Hauke, Frank; Hirsch, Andreas (Corresponding author).

In: Angewandte Chemie (International Edition), Vol. 56, No. 48, 27.11.2017, p. 15267-15273.

Research output: Contribution to journalArticle


Adsorption energies of benzene on close packed transition metal surfaces using the random phase approximation. / Garrido Torres, José A.; Ramberger, Benjamin; Früchtl, Herbert A.; Schaub, Renald; Kresse, Georg.

In: Physical Review Materials, Vol. 1, No. 6, 060803, 22.11.2017.

Research output: Contribution to journalArticle


Free energy calculations for rings and chains formed by dipolar hard spheres. / Ronti, Michela (Corresponding author); Rovigatti, Lorenzo; Tavares, Jose M.; Ivanov, Alexey O.; Kantorovich, Sofia S.; Sciortino, Francesco.

In: Soft Matter, Vol. 13, No. 43, 21.11.2017, p. 7870-7878.

Research output: Contribution to journalArticle


Optically driven ultra-stable nanomechanical rotor. / Kuhn, Stefan (Corresponding author); Stickler, Benjamin A.; Kosloff, Alon; Patolsky, Fernando; Hornberger, Klaus; Arndt, Markus; Millen, James.

In: Nature Communications, Vol. 8, 1670, 21.11.2017.

Research output: Contribution to journalArticle


Structure and electronic states of a graphene double vacancy with an embedded Si dopant. / Nieman, Reed; Aquino, Adelia J. A.; Hardcastle, T.P.; Kotakoski, Jani; Susi, Toma; Lischka, Hans.

In: Journal of Chemical Physics, Vol. 147, No. 19, 194702, 21.11.2017.

Research output: Contribution to journalArticle


Competing magnetic interactions in a spin-1/2 square lattice: Hidden order in Sr2VO4. / Kim, Bongjae (Corresponding author); Khmelevskyi, Sergii; Mohn, Peter; Franchini, Cesare.

In: Physical Review B, Vol. 96, No. 18, 180405, 08.11.2017.

Research output: Contribution to journalArticle


Arrayed Arrangement of 13C Isotopes During the Growth of Inner Single-Walled Carbon Nanotubes. / Koltai, János (Corresponding author); Kuzmany, Hans; Pichler, Thomas; Simon, Ferenc.

In: Physica Status Solidi (B) Basic Research, Vol. 254, No. 11, 1700217, 01.11.2017.

Research output: Contribution to journalArticle


Analysis of Point Defects in Graphene Using Low Dose Scanning Transmission Electron Microscopy Imaging and Maximum Likelihood Reconstruction. / Kramberger, Christian (Corresponding author); Mittelberger, Andreas; Hofer, Christoph; Meyer, Jannik C.

In: Physica Status Solidi. B: Basic Research, Vol. 254, No. 11, 1700176, 11.2017.

Research output: Contribution to journalArticle


Separation of Nickelocene-Filled Single-Walled Carbon Nanotubes by Conductivity Type and Diameter. / Kharlamova, Marianna V. (Corresponding author); Kramberger, Christian; Yanagi, Kazuhiro; Sauer, Markus; Saito, Takeshi; Pichler, Thomas.

In: Physica Status Solidi. B: Basic Research, Vol. 254, No. 11, 1700178, 11.2017.

Research output: Contribution to journalArticle


Structure and Energetics of Embedded Si Patterns in Graphene. / Nosraty Alamdary, Daryoush; Kotakoski, Jani; Susi, Toma.

In: Physica Status Solidi (B) Basic Research, Vol. 254, No. 11, 1700188, 11.2017.

Research output: Contribution to journalArticle


Synthesis of Nitrogen Doped Single Walled Carbon Nanotubes With Caffeine. / Fedi, Filippo (Corresponding author); Domanov, Oleg; Ayala, Paola; Pichler, Thomas.

In: Physica Status Solidi. B: Basic Research, Vol. 254, No. 11, 1700364, 11.2017.

Research output: Contribution to journalArticle


Showing entries 0 - 20 out of 134