26 Aug 16:25
by Benjamin Stadtmüller, Johannes Seidel, Norman Haag, Lisa Grad, Christian Tusche, Gerben van Straaten, Markus Franke, Jürgen Kirschner, Christian Kumpf, Mirko Cinchetti, and Martin Aeschlimann
Author(s): Benjamin Stadtmüller, Johannes Seidel, Norman Haag, Lisa Grad, Christian Tusche, Gerben van Straaten, Markus Franke, Jürgen Kirschner, Christian Kumpf, Mirko Cinchetti, and Martin Aeschlimann
Hybridization-related modifications of the first metal layer of a metal-organic interface are difficult to access experimentally and have been largely neglected so far. Here, we study the influence of specific chemical bonds (as formed by the organic molecules CuPc and PTCDA) on a Pb-Ag surface allo…
[Phys. Rev. Lett. 117, 096805] Published Fri Aug 26, 2016
24 Aug 17:28
by Alberto Verdini, Prasha Shinde, Gian Luca Montanari, Simone Tommaso Suran-Brunelli, Marco Caputo, Giovanni Di Santo, Carlo A. Pignedoli, Luca Floreano, Daniele Passerone, Andrea Goldoni
Abstract
Herein the formation of water molecules in the intermediate step of the redox reaction of porphyrins self-metalation on O/Cu(111) is demonstrated. Photoemission measurements show that the temperature on which porphyrins pick-up a substrate metal atom on O/Cu(111) is reduced by about 185±15 K with respect to the pure Cu(111). DFT calculations clearly indicate that the formation of a water molecule is less expensive than the formation of H2 on the O/Cu(111) substrate and, in some cases, it can be also exothermic.
In the intermediate step of the redox reaction of porphyrins on O/Cu(111) we demonstrate the formation of water molecules. The metalation of porphyrins with Cu occurs at about 185±15 K with respect to the pure Cu(111). DFT calculations clearly indicate that the formation of a water molecule is less expensive than the formation of H2 on the O/Cu(111) substrate (see figure).
24 Aug 16:53
by Michael S. Inkpen

Nature Chemistry 8, 825 (2016).
doi:10.1038/nchem.2553
Authors: Michael S. Inkpen, Stefan Scheerer, Michael Linseis, Andrew J. P. White, Rainer F. Winter, Tim Albrecht & Nicholas J. Long
Cyclic molecules often exhibit unusual properties; consider for example the resonance stabilization energy of benzene or the strong cation binding of crown ethers. Now, a family of rings comprising varying numbers of directly linked ferrocenes has been prepared. These compounds are highly symmetric in solution and undergo rapid ‘oxidation-state isomerism’ when charged.
24 Aug 07:57
by Mohammad Rashidi, Marco Taucer, Isil Ozfidan, Erika Lloyd, Hatem Labidi, Jason L. Pitters, Joseph Maciejko, Robert A. Wolkow
Negative differential resistance remains an attractive but elusive
functionality, so far only finding niche applications. Atom scale entities have
shown promising properties, but viability of device fabrication requires fuller
understanding of electron dynamics than has been possible to date. Using an
all-electronic time-resolved scanning tunneling microscopy technique and a
Green's function transport model, we study an isolated dangling bond on a
hydrogen terminated silicon surface. A robust negative differential resistance
feature is identified as a many body phenomenon related to occupation dependent
electron capture by a single atomic level. We measure all the time constants
involved in this process and present atomically resolved, nanosecond timescale
images to simultaneously capture the spatial and temporal variation of the
observed feature.
18 Aug 16:14
by Arthur Yu, Shaowei Li, Gregory Czap and W. Ho

Nano Letters
DOI: 10.1021/acs.nanolett.6b01824
17 Aug 18:15
by P. Sessi, P. Rüßmann, T. Bathon, A. Barla, K. A. Kokh, O. E. Tereshchenko, K. Fauth, S. K. Mahatha, M. A. Valbuena, S. Godey, F. Glott, A. Mugarza, P. Gargiani, M. Valvidares, N. H. Long, C. Carbone, P. Mavropoulos, S. Blügel, and M. Bode
Author(s): P. Sessi, P. Rüßmann, T. Bathon, A. Barla, K. A. Kokh, O. E. Tereshchenko, K. Fauth, S. K. Mahatha, M. A. Valbuena, S. Godey, F. Glott, A. Mugarza, P. Gargiani, M. Valvidares, N. H. Long, C. Carbone, P. Mavropoulos, S. Blügel, and M. Bode
Recently it has been shown that surface magnetic doping of topological insulators induces backscattering of Dirac states which are usually protected by time-reversal symmetry [Sessi et al., Nat. Commun. 5, 5349 (2014)]. Here we report on quasiparticle interference measurements where, by improved Fe…
[Phys. Rev. B 94, 075137] Published Wed Aug 17, 2016
12 Aug 20:28
by Manuel Gruber and Richard Berndt

The Journal of Physical Chemistry C
DOI: 10.1021/acs.jpcc.6b06089
12 Aug 18:44
by E. C. T. O’Farrell, J. Y. Tan, Y. Yeo, G. K. W. Koon, B. Özyilmaz, K. Watanabe, and T. Taniguchi
Author(s): E. C. T. O’Farrell, J. Y. Tan, Y. Yeo, G. K. W. Koon, B. Özyilmaz, K. Watanabe, and T. Taniguchi
We intercalate a van der Waals heterostructure of graphene and hexagonal boron nitride with Au, by encapsulation, and show that the Au at the interface is two dimensional. Charge transfer upon current annealing indicates the redistribution of the Au and induces splitting of the graphene band structu…
[Phys. Rev. Lett. 117, 076603] Published Fri Aug 12, 2016
09 Aug 08:42
by Nils M. Freitag, Larisa A. Chizhova, Peter Nemes-Incze, Colin R. Woods, Roman V. Gorbachev, Yang Cao, Andre K. Geim, Kostya S. Novoselov, Joachim Burgdörfer, Florian Libisch and Markus Morgenstern

Nano Letters
DOI: 10.1021/acs.nanolett.6b02548
09 Aug 08:41
by Masahiko G. Yamada, Tomohiro Soejima, Naoto Tsuji, Daisuke Hirai, Mircea Dincă, and Hideo Aoki
Author(s): Masahiko G. Yamada, Tomohiro Soejima, Naoto Tsuji, Daisuke Hirai, Mircea Dincă, and Hideo Aoki
We design from first principles a type of two-dimensional metal-organic framework (MOF) using phenalenyl-based ligands to exhibit a half-filled flat band of the kagome lattice, which is one of a family of lattices that show Lieb-Mielke-Tasaki's flat-band ferromagnetism. Among various MOFs, we find t…
[Phys. Rev. B 94, 081102(R)] Published Mon Aug 08, 2016
05 Aug 19:09
by Jun Li, Stefano Gottardi, Leonid Solianyk, Juan Carlos Moreno-López and Meike Stöhr

The Journal of Physical Chemistry C
DOI: 10.1021/acs.jpcc.6b05541
05 Aug 16:40
by Tao Li, Gengwen Tan, Dong Shao, Jing Li, Zaichao Zhang, You Song, Yunxia Sui, Sheng Chen, Yong Fang and Xinping Wang

Journal of the American Chemical Society
DOI: 10.1021/jacs.6b05863
05 Aug 15:44
by Hao Ding, Yan-Feng Lv, Kun Zhao, Wen-Lin Wang, Lili Wang, Can-Li Song, Xi Chen, Xu-Cun Ma, and Qi-Kun Xue
Author(s): Hao Ding, Yan-Feng Lv, Kun Zhao, Wen-Lin Wang, Lili Wang, Can-Li Song, Xi Chen, Xu-Cun Ma, and Qi-Kun Xue
We report on the observation of high-temperature (Tc) superconductivity and magnetic vortices in single-unit-cell FeSe films on anatase TiO2(001) substrate by using scanning tunneling microscopy. A systematic study and engineering of interfacial properties has clarified the essential roles of substr…
[Phys. Rev. Lett. 117, 067001] Published Fri Aug 05, 2016
02 Aug 20:08
by F. Ciccullo, A. Calzolari, I. Píš, S.-A. Savu, M. Krieg, H. F. Bettinger, E. Magnano, T. Chassé and M. B. Casu

The Journal of Physical Chemistry C
DOI: 10.1021/acs.jpcc.6b06237
02 Aug 15:31
by Adina Luican-Mayer, Jose E. Barrios-Vargas, Jesper Toft Falkenberg, Gabriel Autès, Aron W. Cummings, David Soriano, Guohong Li, Mads Brandbyge, Oleg V. Yazyev, Stephan Roche, Eva Y. Andrei
Recent advances in large-scale synthesis of graphene and other 2D materials
have underscored the importance of local defects such as dislocations and grain
boundaries (GBs), and especially their tendency to alter the electronic
properties of the material. Understanding how the polycrystalline morphology
affects the electronic properties is crucial for the development of
applications such as flexible electronics, energy harvesting devices or
sensors. We here report on atomic scale characterization of several GBs and on
the structural-dependence of the localized electronic states in their vicinity.
Using low temperature scanning tunneling microscopy (STM) and spectroscopy
(STS), together with tight binding and ab initio numerical simulations we
explore GBs on the surface of graphite and elucidate the interconnection
between the local density of states (LDOS) and their atomic structure. We show
that the electronic fingerprints of these GBs consist of pronounced resonances
which, depending on the relative orientation of the adjacent crystallites,
appear either on the electron side of the spectrum or as an electron-hole
symmetric doublet close to the charge neutrality point. These two types of
spectral features will impact very differently the transport properties
allowing, in the asymmetric case to introduce transport anisotropy which could
be utilized to design novel growth and fabrication strategies to control device
performance.
30 Jul 08:21
by Nils Krane, Christian Lotze, Julia M. Läger, Gaël Reecht and Katharina J. Franke

Nano Letters
DOI: 10.1021/acs.nanolett.6b02101
29 Jul 09:51
by Jian Li
Article
Chiral p-wave superconductors may form the basis for topological quantum computers however one has yet to be identified. Here, the authors propose that such a state may be created by a two-dimensional array of magnetic adatoms on the surface of a superconductor with strong spin-orbit coupling.
Nature Communications doi: 10.1038/ncomms12297
Authors: Jian Li, Titus Neupert, Zhijun Wang, A. H. MacDonald, A. Yazdani, B. Andrei Bernevig
27 Jul 19:39
by Francesco Parrino, Giovanni Camera Roda, Vittorio Loddo, Leonardo Palmisano
Abstract
Significant production of elemental bromine (Br2) was observed for the first time when treating bromide containing solutions at acidic pH, with TiO2 photocatalyst, ozone, or a combination thereof. Br2 selectivities up to approximately 85 % were obtained and the corresponding bromine mass balance values satisfied. The process is general and may be applied at a laboratory scale for green bromination reactions, or industrially as a cheap, safe, and environmentally sustainable alternative to the currently applied bromine production methods.
Brimming with bromine: Significant production of bromine was observed when acidic solutions of bromide were treated with a TiO2 photocatalyst, and/or ozone. Bromine selectivities up to approximately 85 % were obtained with a corresponding atomic mass balance. The general process may be applied at a laboratory scale, or industrially as a cheap, safe, and environmentally sustainable alternative to current production methods.
26 Jul 18:51
by Jia Liu, Thomas Dienel, Junzhi Liu, Oliver Groening, Jinming Cai, Xinliang Feng, Klaus Müllen, Pascal Ruffieux and Roman Fasel

The Journal of Physical Chemistry C
DOI: 10.1021/acs.jpcc.6b05495
yjdlut and -1 others like this
26 Jul 08:24
by D. Jacob, J. Fernández-Rossier
Quantum spin tunneling (QST) and Kondo effect are two very different quantum
phenomena that produce the same effect on quantized spins, namely, the
quenching of their magnetization. However, the nature of this quenching is very
different so that QST and Kondo effects compete with each other. Importantly,
both QST and Kondo produce very characteristic features in the spectral
function that can be measured by means of single spin scanning tunneling
spectroscopy that makes it possible to probe the crossover from one regime to
the other. We model this crossover, and the resulting changes in transport,
using a non-perturbative treatment of a generalized Anderson model including
magnetic anisotropy that leads to quantum spin tunneling. We predict that, at
zero magnetic field, integer spins can feature a split-Kondo peak driven by
quantum spin tunneling.
26 Jul 08:17
by E. C. T. O'Farrell, J.Y. Tan, Y. Yeo, G.K.W. Koon, K. Watanabe, T. Taniguchi, B. Özyilmaz
We intercalate a van der Waals heterostructure of graphene and hexagonal
Boron Nitride with Au, by encapsulation, and show that Au at the interface is
two dimensional. A charge transfer upon current annealing indicates
redistribution of Au and induces splitting of the graphene bandstructure. The
effect of in plane magnetic field confirms that splitting is due to
spin-splitting and that spin polarization is in the plane, characteristic of a
Rashba interaction with magnitude approximately 25 meV. Consistent with the
presence of intrinsic interfacial electric field we show that the splitting can
be enhanced by an applied displacement field in dual gated samples. Giant
negative magnetoresistance, up to 75%, and a field induced anomalous Hall
effect at magnetic fields < 1 T are observed. These demonstrate that hybridized
Au has a magnetic moment and suggests the proximity to formation of a
collective magnetic phase. These effects persist close to room temperature.
25 Jul 16:05
by Nolan M. Gallagher, Jackson J. Bauer, Maren Pink, Suchada Rajca and Andrzej Rajca

Journal of the American Chemical Society
DOI: 10.1021/jacs.6b05080
25 Jul 11:22
by Carlos Sánchez-Sánchez, Thomas Dienel, Okan Deniz, Pascal Ruffieux, Reinhard Berger, Xinliang Feng, Klaus Müllen and Roman Fasel

ACS Nano
DOI: 10.1021/acsnano.6b04025
21 Jul 19:25
by Holger Helten
Abstract
The replacement of C=C units by their isoelectronic and isosteric B=N units (BN/CC isosterism) in π-conjugated organic compounds, as a strategy to produce novel organic–inorganic hybrid materials, has recently been successfully transferred to π-conjugated polymers. This Concept provides an overview of the recent advances in this quickly evolving field, with a focus on synthesis, photophysical and electrochemical properties of the new polymers and related oligomers, as well as possible future applications in organic electronics and optoelectronics.
The strategy to create novel organic–inorganic hybrid materials by isoelectronic substitution of B=N for C=C units has recently been successfully transferred to π-conjugated polymers. The advances in this quickly evolving field are discussed, with a focus on synthesis and electronic properties of the materials produced, as well as possible future applications in organic electronics.
20 Jul 10:37
by Maria Stamenova, Jacopo Simoni, and Stefano Sanvito
Author(s): Maria Stamenova, Jacopo Simoni, and Stefano Sanvito
The ultrafast demagnetization of small iron clusters initiated by an intense optical excitation is studied from the time-dependent spin density functional theory (TDSDFT). In particular we investigate the effect of the spin-orbit interaction on the onset of the demagnetization process. It is found t…
[Phys. Rev. B 94, 014423] Published Tue Jul 19, 2016
20 Jul 09:47
by J. P. Sun
Article
The relationship between electronic ordering and superconductivity, crucial to understand high- T
c superconductors, remains elusive. Here, Sun et al . report the pressure-induced dome shape of a magnetic phase superceding the nematic order in FeSe, suggesting competing nature between magnetism and superconductivity.
Nature Communications doi: 10.1038/ncomms12146
Authors: J. P. Sun, K. Matsuura, G. Z. Ye, Y. Mizukami, M. Shimozawa, K. Matsubayashi, M. Yamashita, T. Watashige, S. Kasahara, Y. Matsuda, J. -Q. Yan, B. C. Sales, Y. Uwatoko, J. -G. Cheng, T. Shibauchi
20 Jul 09:47
by Qisi Wang
Article
Different ground states of high-temperature superconductors reveal complex nature of magnetism. Here, Wang et al . report stripe and Néel spin fluctuations coexisting with non-magnetic nematic phase in FeSe, providing a viewpoint towards understanding the magnetism of cuprate and iron-based superconductors.
Nature Communications doi: 10.1038/ncomms12182
Authors: Qisi Wang, Yao Shen, Bingying Pan, Xiaowen Zhang, K. Ikeuchi, K. Iida, A. D. Christianson, H. C. Walker, D. T. Adroja, M. Abdel-Hafiez, Xiaojia Chen, D. A. Chareev, A. N. Vasiliev, Jun Zhao
19 Jul 11:42
by Kaushik Bairagi
Article
Spin crossover molecules may find applications in ultimately small magnetic devices, given the sensitivity of their spin-states to external stimuli. Here, the authors show a light-induced transition between two ordered dynamic phases in two-dimensional spin crossover layers on a metallic surface.
Nature Communications doi: 10.1038/ncomms12212
Authors: Kaushik Bairagi, Olga Iasco, Amandine Bellec, Alexey Kartsev, Dongzhe Li, Jérôme Lagoute, Cyril Chacon, Yann Girard, Sylvie Rousset, Frédéric Miserque, Yannick J Dappe, Alexander Smogunov, Cyrille Barreteau, Marie-Laure Boillot, Talal Mallah, Vincent Repain
15 Jul 08:11
by J. R. Bindel, J. Ulrich, M. Liebmann, M. Morgenstern
The inversion layer of p-InSb(110) obtained by Cs adsorption of 1.8 % of a
monolayer is used to probe the Landau level wave functions within smooth
potential valleys by scanning tunnelling spectroscopy at 14 T. The nodal
structure becomes apparent as a double peak structure of each spin polarized
first Landau level, while the zeroth Landau level exhibits a single peak per
spin level only. The real space data show single rings of the valley-confined
drift states for the zeroth Landau level and double rings for the first Landau
level. The result is reproduced by a recursive Green's function algorithm using
the potential landscape obtained experimentally. We show that the result is
generic by comparing the local density of states from the Green's function
algorithm with results from a well controlled analytic model based on the
guiding center approach.
15 Jul 08:10
by Fabian D. Natterer, Kai Yang, William Paul, Philip Willke, Taeyoung Choi, Thomas Greber, Andreas J. Heinrich, Christopher P. Lutz
The highest-density magnetic storage media will code data in single-atom
bits. To date, the smallest individually addressable bistable magnetic bits on
surfaces consist of 5-12 atoms. Long magnetic relaxation times were
demonstrated in molecular magnets containing one lanthanide atom, and recently
in ensembles of single holmium (Ho) atoms supported on magnesium oxide (MgO).
Those experiments indicated the possibility for data storage at the fundamental
limit, but it remained unclear how to access the individual magnetic centers.
Here we demonstrate the reading and writing of individual Ho atoms on MgO, and
show that they independently retain their magnetic information over many hours.
We read the Ho states by tunnel magnetoresistance and write with current pulses
using a scanning tunneling microscope. The magnetic origin of the long-lived
states is confirmed by single-atom electron paramagnetic resonance (EPR) on a
nearby Fe sensor atom, which shows that Ho has a large out-of-plane moment of
$(10.1 \pm 0.1)$ $\mu_{\rm B}$ on this surface. In order to demonstrate
independent reading and writing, we built an atomic scale structure with two Ho
bits to which we write the four possible states and which we read out remotely
by EPR. The high magnetic stability combined with electrical reading and
writing shows that single-atom magnetic memory is possible.