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Wolf, Christoph,Kim, Joo-Sung,Lee, Tae-Woo American Chemical Society 2017 ACS APPLIED MATERIALS & INTERFACES Vol.9 No.12
<P>We extracted the electronic disorder energy of the organic inorganic lead-halide hybrid perovskite CH3NH3PbBr3 from temperature-dependent absorption data. We showed that the disorder at room temperature is similar to 30 meV and is due to strong electron-phonon coupling with the longitudinal-optical mode of energy 16 meV. This mode can be attributed to longitudinal-optical phonons of the inorganic PbBr6 frame; this conclusion highlights the polaronic nature of electronic excitations in CH3NH3PbBr3. We showed that structural disorder is of the same impact as thermal disorder. A temperature-dependence of the exciton binding energy was observed close to the orthorhombic-to-tetragonal phase-transition temperature.</P>
Christopher Pivetti,홍인철,Chang H. Yoo,이선,Kenny Kim,Gregory Emmanuel,Jason KIm,Romy Chung,Slawomir Niewiadomski,Paul Wolf,R. F. Gittes 연세대학교의과대학 2004 Yonsei medical journal Vol.45 No.6
Comparison of pancreaticoduodenal transplants (PDT) and duct-ligated pancreas transplant (DLPT) were performed using syngeneic and allogeneic studies in rats. Both DLPT and PDT allogeneic grafts showed mild rejection. DLPT groups showed disorganized pathology and acini replaced by fat. Eventually, massive fibrosis was seen in the Islets of Langerhans, as well as rejection cellular infiltrates. In both PDT groups, normal histology was observed in the same period. Thus the effect of duct occlusion is highly detrimental for the grafts.
Equivalence Heuristics for Malleability-Aware Skylines
Christoph Lofi,Wolf-Tilo Balke,Ulrich Güntzer 한국정보과학회 2012 Journal of Computing Science and Engineering Vol.6 No.3
In recent years, the skyline query paradigm has been established as a reliable method for database query personalization. While early efficiency problems have been solved by sophisticated algorithms and advanced indexing, new challenges in skyline retrieval effectiveness continuously arise. In particular, the rise of the Semantic Web and linked open data leads to personalization issues where skyline queries cannot be applied easily. We addressed the special challenges presented by linked open data in previous work; and now further extend this work, with a heuristic workflow to boost efficiency. This is necessary; because the new view on linked open data dominance has serious implications for the efficiency of the actual skyline computation, since transitivity of the dominance relationships is no longer granted. Therefore, our contributions in this paper can be summarized as: we present an intuitive skyline query paradigm to deal with linked open data; we provide an effective dominance definition, and establish its theoretical properties; we develop innovative skyline algorithms to deal with the resulting challenges; and we design efficient heuristics for the case of predicate equivalences that may often happen in linked open data. We extensively evaluate our new algorithms with respect to performance, and the enriched skyline semantics.
Equivalence Heuristics for Malleability-Aware Skylines
Lofi, Christoph,Balke, Wolf-Tilo,Guntzer, Ulrich Korean Institute of Information Scientists and Eng 2012 Journal of Computing Science and Engineering Vol.6 No.3
In recent years, the skyline query paradigm has been established as a reliable method for database query personalization. While early efficiency problems have been solved by sophisticated algorithms and advanced indexing, new challenges in skyline retrieval effectiveness continuously arise. In particular, the rise of the Semantic Web and linked open data leads to personalization issues where skyline queries cannot be applied easily. We addressed the special challenges presented by linked open data in previous work; and now further extend this work, with a heuristic workflow to boost efficiency. This is necessary; because the new view on linked open data dominance has serious implications for the efficiency of the actual skyline computation, since transitivity of the dominance relationships is no longer granted. Therefore, our contributions in this paper can be summarized as: we present an intuitive skyline query paradigm to deal with linked open data; we provide an effective dominance definition, and establish its theoretical properties; we develop innovative skyline algorithms to deal with the resulting challenges; and we design efficient heuristics for the case of predicate equivalences that may often happen in linked open data. We extensively evaluate our new algorithms with respect to performance, and the enriched skyline semantics.
Chan Miller, Christopher,Jacob, Daniel J.,Marais, Eloise A.,Yu, Karen,Travis, Katherine R.,Kim, Patrick S.,Fisher, Jenny A.,Zhu, Lei,Wolfe, Glenn M.,Hanisco, Thomas F.,Keutsch, Frank N.,Kaiser, Jennif Copernicus GmbH 2017 Atmospheric Chemistry and Physics Vol.17 No.14
<P>Abstract. Glyoxal (CHOCHO) is produced in the atmosphere by the oxidation of volatile organic compounds (VOCs). Like formaldehyde (HCHO), another VOC oxidation product, it is measurable from space by solar backscatter. Isoprene emitted by vegetation is the dominant source of CHOCHO and HCHO in most of the world. We use aircraft observations of CHOCHO and HCHO from the SENEX campaign over the southeast US in summer 2013 to better understand the CHOCHO time-dependent yield from isoprene oxidation, its dependence on nitrogen oxides (NOx ≡ NO + NO2), the behavior of the CHOCHO-HCHO relationship, the quality of OMI CHOCHO satellite observations, and the implications for using CHOCHO observations from space as constraints on isoprene emissions. We simulate the SENEX and OMI observations with the Goddard Earth Observing System chemical transport model (GEOS-Chem) featuring a new chemical mechanism for CHOCHO formation from isoprene. The mechanism includes prompt CHOCHO formation under low-NOx conditions following the isomerization of the isoprene peroxy radical (ISOPO2). The SENEX observations provide support for this prompt CHOCHO formation pathway, and are generally consistent with the GEOS-Chem mechanism. Boundary layer CHOCHO and HCHO are strongly correlated in the observations and the model, with some departure under low-NOx conditions due to prompt CHOCHO formation. SENEX vertical profiles indicate a free-tropospheric CHOCHO background that is absent from the model. The OMI CHOCHO data provide some support for this free-tropospheric background and show southeast US enhancements consistent with the isoprene source but a factor of 2 too low. Part of this OMI bias is due to excessive surface reflectivities assumed in the retrieval. The OMI CHOCHO and HCHO seasonal data over the southeast US are tightly correlated and provide redundant proxies of isoprene emissions. Higher temporal resolution in future geostationary satellite observations may enable detection of the prompt CHOCHO production under low-NOx conditions apparent in the SENEX data. </P>
antiSMASH 4.0—improvements in chemistry prediction and gene cluster boundary identification
Blin, Kai,Wolf, Thomas,Chevrette, Marc G.,Lu, Xiaowen,Schwalen, Christopher J.,Kautsar, Satria A.,Suarez ,Duran, Hernando G.,de ,los ,Santos, Emmanuel ,L. ,C.,Kim, Hyun Uk,Nave, Ma Oxford University Press 2017 Nucleic acids research Vol.45 No.w1
<P><B>Abstract</B></P><P>Many antibiotics, chemotherapeutics, crop protection agents and food preservatives originate from molecules produced by bacteria, fungi or plants. In recent years, genome mining methodologies have been widely adopted to identify and characterize the biosynthetic gene clusters encoding the production of such compounds. Since 2011, the ‘antibiotics and secondary metabolite analysis shell—antiSMASH’ has assisted researchers in efficiently performing this, both as a web server and a standalone tool. Here, we present the thoroughly updated antiSMASH version 4, which adds several novel features, including prediction of gene cluster boundaries using the ClusterFinder method or the newly integrated CASSIS algorithm, improved substrate specificity prediction for non-ribosomal peptide synthetase adenylation domains based on the new SANDPUMA algorithm, improved predictions for terpene and ribosomally synthesized and post-translationally modified peptides cluster products, reporting of sequence similarity to proteins encoded in experimentally characterized gene clusters on a per-protein basis and a domain-level alignment tool for comparative analysis of <I>trans</I>-AT polyketide synthase assembly line architectures. Additionally, several usability features have been updated and improved. Together, these improvements make antiSMASH up-to-date with the latest developments in natural product research and will further facilitate computational genome mining for the discovery of novel bioactive molecules.</P>
Kim, Young-Hoon,Wolf, Christoph,Kim, Young-Tae,Cho, Himchan,Kwon, Woosung,Do, Sungan,Sadhanala, Aditya,Park, Chan Gyung,Rhee, Shi-Woo,Im, Sang Hyuk,Friend, Richard H.,Lee, Tae-Woo American Chemical Society 2017 ACS NANO Vol.11 No.7
<P>Colloidal metal-halide perovskite quantum dots (QDs) with a dimension less than the exciton Bohr diameter D-B (quantum size regime) emerged as promising light emitters due to their spectrally narrow light, facile color tuning, and high photoluminescence quantum efficiency (PLQE). However, their size-sensitive emission wavelength and color purity and low electroluminescence efficiency are still challenging aspects. Here, we demonstrate highly efficient light-emitting diodes (LEDs) based on the colloidal perovskite nano crystals (NCs) in a dimension > D-B (regime beyond quantum size) by using a multifunctional buffer hole injection layer (Buf-HIL). The perovskite NCs with a dimension greater than D-B show a size-irrespective high color purity and PLQE by managing the recombination of excitons occurring at surface traps and inside the NCs. The Buf-HIL composed of poly(3,4-ethylenedioxythiophene)/poly(styrenesulfonate) (PEDOT:PSS) and per fluorinated ionomer induces uniform perovskite particle films with complete film coverage and prevents exciton quenching at the PEDOT:PSS/perovskite particle film interface. With these strategies, we achieved a very high PLQE (similar to 60.5%) in compact perovskite particle films without any complex post-treatments and multilayers and a high current efficiency of 15.5 cd/A in the LEDs of colloidal perovskite NCs, even in a simplified structure, which is the highest efficiency to date in green LEDs that use colloidal organic-inorganic metal-halide perovskite nanoparticles including perovskite QDs and NCs. These results can help to guide development of various light-emitting optoelectronic applications based on perovskite NCs.</P>