Physics - Research - Working groups - Computational Condensed Matter Theory Chair - Publications
Publications
Publication lists are available on Google Scholar for F. Evers (external link, opens in a new window) and J. Wilhelm (external link, opens in a new window).
- Weik, Norman, Schindler, Johannes, Bera, Soumya, Solomon, Gemma C. and Evers, Ferdinand (2016) Graphene with vacancies: Supernumerary zero modes.
Physical Review B, 94 (6) AMER PHYSICAL SOC, COLLEGE PK, 064204.
https://dx.doi.org/10.1103/PhysRevB.94.064204 - Kaplan, F., Harding, M. E., Seiler, C., Weigend, F., Evers, F. and van Setten, M. J. (2016) Quasi-Particle Self-Consistent GW for Molecules.
Journal of Chemical Theory and Computation, 12 (6) AMER CHEMICAL SOC, WASHINGTON, 2528-2541.
https://dx.doi.org/10.1021/acs.jctc.5b01238 - Kaplan, F., Weigend, F., Evers, Ferdinand and van Setten, M. J. (2015) Off-Diagonal Self-Energy Terms and Partially Self-Consistency in GW Calculations for Single Molecules: Efficient Implementation and Quantitative Effects on Ionization Potentials.
Journal of Chemical Theory and Computation, 11 (11) AMER CHEMICAL SOC, WASHINGTON, 5152-5160.
https://dx.doi.org/10.1021/acs.jctc.5b00394 - Wilhelm, Jan, Walz, Michael and Evers, Ferdinand (2015) Ab initio spin-flip conductance of hydrogenated graphene nanoribbons: Spin-orbit interaction and scattering with local impurity spins.
Physical Review B, 92 (1) AMER PHYSICAL SOC, COLLEGE PK, 014405.
https://dx.doi.org/10.1103/PhysRevB.92.014405 - Adak, Olgun, Korytár, Richard, Joe, Andrew Y., Evers, Ferdinand and Venkataraman, Latha (2015) Impact of Electrode Density of States on Transport through Pyridine-Linked Single Molecule Junctions.
Nano Letters, 15 (6) AMER CHEMICAL SOC, WASHINGTON, 3716-3722.
https://dx.doi.org/10.1021/acs.nanolett.5b01195 - Toscano, Giuseppe, Straubel, Jakob, Kwiatkowski, Alexander, Rockstuhl, Carsten, Evers, Ferdinand, Xu, Hongxing, Asger Mortensen, N. and Wubs, Martijn (2015) Resonance shifts and spill-out effects in self-consistent hydrodynamic nanoplasmonics.
Nature Communications, 6 (1) NATURE PUBLISHING GROUP, LONDON, 7132.
https://dx.doi.org/10.1038/ncomms8132 - Zhang, L., Bagrets, A., Xenioti, D., Korytár, R., Schackert, M., Miyamachi, T., Schramm, F., Fuhr, O., Chandrasekar, R., Alouani, M., Ruben, M., Wulfhekel, W. and Evers, Ferdinand (2015) Kondo effect in binuclear metal-organic complexes with weakly interacting spins.
Physical Review B, 91 (19) American Physical Society, 195424.
https://dx.doi.org/10.1103/PhysRevB.91.195424 - Devid, Edwin J., Martinho, Paulo N., Kamalakar, M. Venkata, Šalitroš, Ivan, Prendergast, Úna, Dayen, Jean-François, Meded, Velimir, Lemma, Tibebe, González-Prieto, Rodrigo, Evers, Ferdinand, Keyes, Tia E., Ruben, Mario, Doudin, Bernard and van der Molen, Sense Jan (2015) Spin Transition in Arrays of Gold Nanoparticles and Spin Crossover Molecules.
ACS Nano, 9 (4) American Chemical Society, 4496-4507.
https://dx.doi.org/10.1021/acsnano.5b01103 - Wilhelm, J., Walz, M. and Evers, F. (2015) Ab initio spin-flip conductance of hydrogenated graphene nanoribbons: spin- orbit interaction and scattering with local impurity sites.
Physical Review B (PRB), (92) AMER PHYSICAL SOC, COLLEGE PK, 014405.
https://dx.doi.org/10.1103/PhysRevB.92.014405 - van Setten, M. J., Caruso, F., Sharifzadeh, S., Ren, X., Scheffler, M., Liu, F., Lischner, J., Lin, L., Deslippe, J. R., Louie, S., Yang, C., Weigend, F., Neaton, J. B., Evers, F. and Rinke, P. (2015) GW 100: Benchmarking G0W0 for molecular systems.
Journal of Chemical Theory and Computation, 11 (12) AMER CHEMICAL SOC, WASHINGTON, 5665-5687.
https://dx.doi.org/10.1021/acs.jctc.5b00453 - Walz, Michael, Bagrets, Alexei and Evers, Ferdinand (2015) Local Current Density Calculations for Molecular Films from Ab Initio.
Journal of Chemical Theory and Computation, 11 (11) AMER CHEMICAL SOC, WASHINGTON, 5161-5176.
https://dx.doi.org/10.1021/acs.jctc.5b00471 - Rakhmilevitch, D., Korytár, R., Bagrets, A., Evers, Ferdinand and Tal, O. (2014) Electron-Vibration Interaction in the Presence of a Switchable Kondo Resonance Realized in a Molecular Junction.
Physical Review Letters, 113 (23), 236603.
https://dx.doi.org/10.1103/PhysRevLett.113.236603 - Schnäbele, Paul, Korytár, Richard, Bagrets, Alexei, Roman, Tanglaw, Schimmel, Thomas, Groß, Axel and Evers, Ferdinand (2014) Ab Initio Transport Calculations for Single-Atom Copper Junctions in the Presence of Hydrogen Chloride.
The Journal of Physical Chemistry C, 118 (48) American Chemical Society, 28252-28257.
https://dx.doi.org/10.1021/jp5093898 - Häfner, V., Schindler, J., Weik, N., Mayer, T., Balakrishnan, S., Narayanan, R., Bera, S. and Evers, Ferdinand (2014) Density of States in Graphene with Vacancies: Midgap Power Law and Frozen Multifractality.
Physical Review Letters, 113 (18) American Physical Society (APS), 186802.
https://dx.doi.org/10.1103/PhysRevLett.113.186802 - Walz, Michael, Wilhelm, Jan and Evers, Ferdinand (2014) Current Patterns and Orbital Magnetism in Mesoscopic dc Transport.
Physical Review Letters, 113 (13) American Physical Society (APS), 136602.
https://dx.doi.org/10.1103/PhysRevLett.113.136602 - Lin, Xiaohang, Dasgupta, Arindam, Xie, Fangqing, Schimmel, Thomas, Evers, Ferdinand and Groß, Axel (2014) Exchange processes in the contact formation of Pb electrodes.
Electrochimica Acta, 140 Elsevier, 505-510.
https://dx.doi.org/10.1016/j.electacta.2014.05.160 - Wilhelm, Jan, Walz, Michael and Evers, Ferdinand (2014) Ab initio quantum transport through armchair graphene nanoribbons: Streamlines in the current density.
Physical Review B, 89 (19) American Institute of Physics
https://dx.doi.org/10.1103/PhysRevB.89.195406 - Korytár, Richard, Xenioti, Dimitra, Schmitteckert, Peter, Alouani, Mébarek and Evers, Ferdinand (2014) Signature of the Dirac cone in the properties of linear oligoacenes.
Nature Communications, 5 (1) Springer, 5000.
https://dx.doi.org/10.1038/ncomms6000 - Géranton, G., Seiler, C., Bagrets, A., Venkataraman, L. and Evers, Ferdinand (2013) Transport properties of individual C60-molecules.
The Journal of Chemical Physics, 139 (23) American Institute of Physics (AIP), 234701.
https://dx.doi.org/10.1063/1.4840535 - Korytár, Richard and Evers, Ferdinand (2013) Spin locking at the apex of nano-scale platinum tips.
Surface Science, 618 Elsevier, 49-52.
https://dx.doi.org/10.1016/j.susc.2013.09.008 - Obuse, H., Bera, S., Ludwig, A. W. W., Gruzberg, I. A. and Evers, Ferdinand (2013) Statistics of conductances and subleading corrections to scaling near the integer quantum Hall plateau transition.
EPL (Europhysics Letters), 104 (2) Institute of Physics Publishing (IOP), 27014.
https://dx.doi.org/10.1209/0295-5075/104/27014 - Evers, Ferdinand and Schmitteckert, P. (2013) Density functional theory with exact XC potentials: Lessons from DMRG studies and exactly solvable models.
physica status solidi (b), 250 (11) Wiley, 2330-2341.
https://dx.doi.org/10.1002/pssb.201349901 - Evers, Ferdinand and Schmitteckert, P. (2013) Invariants of the single-impurity Anderson model and implications for conductance functionals.
EPL (Europhysics Letters), 103 (4) Institute of Physics Publishing (IOP), 47012.
https://dx.doi.org/10.1209/0295-5075/103/47012 - Yelin, Tamar, Vardimon, Ran, Kuritz, Natalia, Korytár, Richard, Bagrets, Alexei, Evers, Ferdinand, Kronik, Leeor and Tal, Oren (2013) Atomically Wired Molecular Junctions: Connecting a Single Organic Molecule by Chains of Metal Atoms.
Nano Letters, 13 (5) ACS Publications, 1956-1961.
https://dx.doi.org/10.1021/nl304702z - Bajales, Noelia, Schmaus, Stefan, Miyamashi, Toshio, Wulfhekel, Wulf, Wilhelm, Jan, Walz, Michael, Stendel, Melanie, Bagrets, Alexei, Evers, Ferdinand, Ulas, Seyithan, Kern, Bastian, Böttcher, Artur and Kappes, Manfred M. (2013) C58 on Au(111): A scanning tunneling microscopy study.
The Journal of Chemical Physics, 138 (10) American Institute of Physics (AIP), 104703.
https://dx.doi.org/10.1063/1.4793761