Publications



2020


Unveiling the reaction mechanism of novel copperN-alkylated tetra-azacyclophanes with outstanding superoxide dismutase activity. / Martinez-Camarena, Alvaro (Corresponding author); Sanchez-Murcia, Pedro A. (Corresponding author); Blasco, Salvador et al.
In: Chemical Communications, Vol. 56, No. 54, 11.07.2020, p. 7511-7514.

Publications: Contribution to journalArticlePeer Reviewed


Doping Evolution of the Local Electronic and Structural Properties of the Double Perovskite Ba2Na1-xCaxOsO6. / Kesavan, Jagadesh Kopula; Fiore Mosca, Dario; Sanna, Samuele et al.
In: Journal of Physical Chemistry C, Vol. 124, No. 30, 08.07.2020, p. 16577-16585.

Publications: Contribution to journalArticlePeer Reviewed


Quantum-assisted diamagnetic deflection of molecules. / Fein, Yaakov Y.; Shayeghi, Armin; Kiałka, Filip et al.
In: Physical Chemistry Chemical Physics, Vol. 22, No. 25, 07.07.2020, p. 14036-14041.

Publications: Contribution to journalArticlePeer Reviewed


Vanishing influence of the band gap on the charge exchange of slow highly charged ions in freestanding single-layer MoS2. / Creutzburg, S. (Corresponding author); Schwestka, J.; Niggas, A. et al.
In: Physical Review B, Vol. 102, No. 4, 045408, 07.07.2020.

Publications: Contribution to journalArticlePeer Reviewed


Origin of mean-field behavior in an elastic Ising model. / Frechette, Layne B.; Dellago, Christoph (Corresponding author); Geissler, Phillip L. (Corresponding author).
In: Physical Review B, Vol. 102, No. 2, 024102, 06.07.2020.

Publications: Contribution to journalArticlePeer Reviewed


Aggregation shapes of amphiphilic ring polymers: from spherical to toroidal micelles. / Jehser, Martin; Likos, Christos N. (Corresponding author).
In: Colloid and Polymer Science, Vol. 298, No. 7, 07.2020, p. 735–745.

Publications: Contribution to journalArticlePeer Reviewed


Resolving the adsorption of molecular O2 on the rutile TiO2(110) surface by noncontact atomic force microscopy. / Sokolović, Igor; Reticcioli, Michele; Čalkovský, Martin et al.
In: Proceedings of the National Academy of Sciences of the United States of America (PNAS), Vol. 117, No. 26, 30.06.2020, p. 14827-14837.

Publications: Contribution to journalArticlePeer Reviewed


Ultralong Spin Lifetime in Light Alkali Atom Doped Graphene. / Markus, B. G.; Szirmai, P.; Edelthalhammer, K. F. et al.
In: ACS Nano, Vol. 14, No. 6, 23.06.2020, p. 7492-7501.

Publications: Contribution to journalArticlePeer Reviewed


Descriptors representing two- and three-body atomic distributions and their effects on the accuracy of machine-learned inter-atomic potentials. / Jinnouchi, Ryosuke (Corresponding author); Karsai, Ferenc; Verdi, Carla et al.
In: Journal of Chemical Physics, Vol. 152, No. 23, 234102, 21.06.2020.

Publications: Contribution to journalArticlePeer Reviewed


Scalable growth of single-walled carbon nanotubes with a highly uniform structure. / Hussain, Aqeel; Ding, Er-Xiong; Mclean, Ben et al.
In: Nanoscale, Vol. 12, No. 23, 21.06.2020, p. 12263-12267.

Publications: Contribution to journalArticlePeer Reviewed


Influence of the α-relaxation on the high-velocity stretchability of isotactic polypropylene. / Eichelter, Johanna (Corresponding author); Wilhelm, Harald; Eder, Andreas et al.
In: Polymer, Vol. 200, 122593, 18.06.2020.

Publications: Contribution to journalArticlePeer Reviewed


Diffraction of 80 eV hydrogen through suspended graphene. / Brand, C.; Susi, T.; Kotakoski, J. et al.
In: Journal of Physics: Conference Series, Vol. 1412, 202036, 11.06.2020.

Publications: Contribution to journalMeeting abstract/Conference paperPeer Reviewed


Transformation and Evaporation of Surface Adsorbents on a Graphene "Hot Plate". / Choi, Jun Hee; Shin, Dong Hoon; Inani, Heena et al.
In: ACS Applied Materials and Interfaces, Vol. 12, No. 23, 10.06.2020, p. 26313-26319.

Publications: Contribution to journalArticlePeer Reviewed


Implementation of Coherent Switching with Decay of Mixing into the SHARC Program. / Shu, Yinan; Zhang, Linyao; Mai, Sebastian et al.
In: Journal of Chemical Theory and Computation, Vol. 16, No. 6, 09.06.2020, p. 3464-3475.

Publications: Contribution to journalArticlePeer Reviewed


SrRuO3-SrTiO3 heterostructure as a possible platform for studying unconventional superconductivity in Sr2RuO4. / Kim, Bongjae (Corresponding author); Khmelevskyi, Sergii; Franchini, Cesare et al.
In: Physical Review B, Vol. 101, No. 22, 220502, 08.06.2020.

Publications: Contribution to journalArticlePeer Reviewed


Tunable relativistic quasiparticle electronic and excitonic behavior of the FAPb(I1-xBrx)3 alloy. / Muhammad, Zeeshan; Liu, Peitao; Ahmad, Rashid et al.
In: Physical Chemistry Chemical Physics, Vol. 22, No. 21, 07.06.2020, p. 11943-11955.

Publications: Contribution to journalArticlePeer Reviewed


CASPT2 Potential Energy Curves for NO Dissociation in a Ruthenium Nitrosyl Complex. / Talotta, Francesco; Gonzalez, Leticia; Boggio-Pasqua, Martial (Corresponding author).
In: Molecules, Vol. 25, No. 11, 2613, 06.2020.

Publications: Contribution to journalArticlePeer Reviewed


High-Performance Polymer Foams by Thermally Induced Phase Separation. / Rusakov, Dmitrii; Menner, Angelika; Bismarck, Alexander (Corresponding author).
In: Macromolecular Rapid Communications, Vol. 41, No. 11, 2000110, 06.2020.

Publications: Contribution to journalArticlePeer Reviewed


Matter–wave interference and deflection of tripeptides decorated with fluorinated alkyl chains. / Schätti, Jonas; Köhler, Valentin; Mayor, Marcel et al.
In: Journal of Mass Spectrometry, Vol. 55, No. 6, e4514, 06.2020.

Publications: Contribution to journalArticlePeer Reviewed