single [ Singles & Dating ] Open Question : Is this guy normal? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:10:55 +0000 My friend the dumb joe will ask me for money and try and sell me his garbage because he needs money for a bus fare. He will talk to Asian girls because I think he is not good enough for white girls. He try's to many things. Let's go over some of them. The army the police an astronaut he worked at 5 different supermarkets he got a night job for about 3 weeks and never sleeper at all. He wanted to go to China but cancelled he wanted to go to Auckland but cancelled he wanted to go to Singapore but cancelled. He brought a moped and sold it a week later. He wanted a BMW but didn't get one after he told me he was getting it. He sold me a speaker for $20 and a month later he asked for it back for free and he did not get it. He was on his way to buy a computer and he runs in to a friend and asked him can I have your computer for $200 when the one he was going to buy was $180. He will never learn to drive when he drove into a lamppost. And meny more weird things as well. What is wrong with him? Full Article
single [ Singles & Dating ] Open Question : Is it seen as wrong for women to be protective of themselves, and not reliant on a male protector? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:16:13 +0000 Full Article
single [ Singles & Dating ] Open Question : I’ve been trying to feel pleasure with my eyes wide shut but it keeps on moving ? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:18:49 +0000 Full Article
single [ Singles & Dating ] Open Question : Should I break up with my boyfriend? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:19:38 +0000 I’ve liked him for a year and I told him, but he told me to date someone else. I started to forget about him, but then he told me that he liked me too. We’re dating now but I don’t think that I feel the same was as when I first started liking him. What should I do? Full Article
single [ Singles & Dating ] Open Question : I have an online gf i never met in person,is it cheating if i slept with someone irl? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:20:17 +0000 I have an online gf it seems kind of serious but we've never really made attempts on meeting but i slept with someone irl,is that cheating? Should I tell her? Full Article
single [ Movies ] Open Question : Name of a movie about a man visiting a small town living with a single mom and her son. Everyone thinks he is a coward but he is a war hero? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:25:34 +0000 Full Article
single [ Singles & Dating ] Open Question : How to you put an end to friends with benefits? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:26:39 +0000 I have a fwb trade with this guy who doesnt respect me at all and hurts my feelings because I'm not as attractive as he is and gets annoyed if I dont meet his demands,how do I stop this fwb? I'm scared if he does he'll tell people or get mad at me. Full Article
single [ Singles & Dating ] Open Question : If someone says youre not edgy is that a bad thing? By answers.yahoo.com Published On :: Sun, 10 May 2020 09:30:55 +0000 Full Article
single Happy Mother’s Day: Karisma to Sushmita, a look at Bollywood’s single mum’s who have paved their own way – PINKVILLA By rss-newsfeed.india-meets-classic.net Published On :: Sun, 10 May 2020 06:16:26 +0000 Happy Mother's Day: Karisma to Sushmita, a look at Bollywood's single mum's who have paved their own way PINKVILLAMother’s Day 2020: From Aishwarya Rai to Kareena Kapoor, check out pics of these Bollywood moms and... Hindustan TimesHappy Mother's Day 2020: Kareena Kapoor, Shilpa Shetty lead B-Town stars celebrate motherhood, wish mothers on this precious day | In Pics Jagran EnglishWhen Aishwarya Rai Bachchan was asked to pick between Kareena Kapoor Khan & Rani Mukerji; Here’s what she said PINKVILLAMother’s Day 2020: Single Mothers of Bollywood News18View Full coverage on Google News Full Article IMC News Feed
single Mother’s Day: Here is how a single mother can manage her finances efficiently By www.financialexpress.com Published On :: 2020-05-10T13:45:00+05:30 A single mother should make sure that her earnings are divided into spending, emergency funds, and investments so that sufficient wealth is generated for the realization of future financial goals. If you are also on the same boat, here is how you should go about it. Full Article Money
single The future in a single act By article.wn.com Published On :: Sun, 10 May 2020 01:56 GMT The text version of this document in not available. You can... Full Article
single Happy Mother's Day: Karisma to Sushmita, a look at Bollywood's single mum's who have paved their own way - PINKVILLA By news.google.com Published On :: Sun, 10 May 2020 06:16:26 GMT Happy Mother's Day: Karisma to Sushmita, a look at Bollywood's single mum's who have paved their own way PINKVILLAMother’s Day 2020: Single Mothers of Bollywood News18Happy Mother's Day 2020: Kareena Kapoor, Shilpa Shetty lead B-Town stars celebrate motherhood, wish mothers on this precious day | In Pics Jagran EnglishView Full coverage on Google News Full Article
single Alibaba Rakes Up Record $17.6 Billion On Singles Day Sales By feedproxy.google.com Published On :: Alibaba Group, the e-commerce giant behind the 24-hour Singles' Day shopping blitz, has raked up a record $17. 6 billion in the Singles Day online sales, creating a new record in global retail sales for any single day. Full Article
single Prague: A single speed for progress By www.oecd.org Published On :: Fri, 29 May 2015 11:58:00 GMT A city’s brand is pivotal for its position in global society, particularly in global competition. Indeed, a city has many aspects of a commercial product. The very strong international brand that I represent is Prague, the million-strong capital of the Czech Republic. Full Article
single PETER HITCHENS: Has our mad mass house arrest during Covid-19 saved even a single life? By Published On :: Sat, 09 May 2020 22:10:40 +0100 PETER HITCHENS: We will not escape from this misery until the Government has been forced to admit that it made a foolish mistake and over-reacted wildly to Covid-19. Full Article
single PETER HITCHENS: Has our mad mass house arrest during Covid-19 saved even a single life? By www.dailymail.co.uk Published On :: Sat, 09 May 2020 21:10:40 GMT PETER HITCHENS: We will not escape from this misery until the Government has been forced to admit that it made a foolish mistake and over-reacted wildly to Covid-19. Full Article
single Ana de Armas is a vision of spring as she steps out in a marigold singlet for dog walk in Venice By www.dailymail.co.uk Published On :: Sat, 09 May 2020 22:19:40 GMT Ana de Armas was a vision of spring on Saturday when she stepped out in a marigold colored singlet for a walk around her Venice neighborhood with her dog. Full Article
single Cheyenne Tozzi celebrates Mother's Day as a single mum after splitting from Marlon Teixeira By www.dailymail.co.uk Published On :: Sun, 10 May 2020 06:05:59 GMT Cheyenne Tozzi has shared a sweet tribute to her daughter Dahlia De La Lune, one, as she celebrates Mother's Day as a single parent. Full Article
single 62 Fresh Coronavirus Infections Reported from Single CRPF Unit in Delhi, Active Cases Climb to 231 By www.news18.com Published On :: Sat, 9 May 2020 08:40:03 +0530 The 31st battalion of the force in Delhi has about 137 positive cases. All personnel are admitted at a quarantine facility in Mandoli area and undergoing treatment. Full Article
single Mother's Day 2020: Women In Bollywood Who Inspired Single Mothers Everywhere By www.filmibeat.com Published On :: Sun, 10 May 2020 12:08:57 +0530 Every mother faces their own set of struggles, however, single mothers have a bit of more struggle to face than usual. Bollywood too has seen their fair share of unmarried mothers, whether single or divorced, but they have always put their kids Full Article
single Mother's Day 2020: Women In Bollywood Who Inspired Single Mothers Everywhere By www.filmibeat.com Published On :: Sun, 10 May 2020 12:08:57 +0530 Every mother faces their own set of struggles, however, single mothers have a bit of more struggle to face than usual. Bollywood too has seen their fair share of unmarried mothers, whether single or divorced, but they have always put their kids Full Article
single 227 new COVID-19 cases, sharpest jump in single day By www.rediff.com Published On :: Tue, 31 Mar 2020 08:21:06 +0530 The government said there was no immediate plan to extend the 21-day lockdown period, which entered its sixth day on Monday, while the Indian Army dismissed as "fake" social media posts about a possible emergency declaration next month. Full Article PTI Photo Maharashtra IMAGE Himachal Pradesh Bihar Gujarat Karnataka APMC Madhya Pradesh West Bengal Sarusajai Sports Complex Navi Mumbai Tamil Nadu East Delhi Puducherry Telangana
single With 1,752 cases, India sees biggest single-day jump By www.rediff.com Published On :: Fri, 24 Apr 2020 22:07:16 +0530 A total of 37 deaths were reported since Thursday evening of which 14 fatalities were reported from Maharashtra, nine from Gujarat, three from Uttar Pradesh, two each from Andhra Pradesh, Delhi, Madhya Pradesh,Tamil Nadu and Telengana and one from Karnataka, ministry data stated. Full Article PTI Photo Uttar Pradesh IMAGE Indian Council of Medical Research Gujarat Maharashtra Assam Kerala Jharkhand Madhya Pradesh New Delhi Andhra Pradesh West Bengal Bhopal Municipal Corporation Arunachal Pradesh Nicobar Islands
single Quantification of the mixed-valence and intervalence charge transfer properties of a cofacial metal–organic framework via single crystal electronic absorption spectroscopy By feeds.rsc.org Published On :: Chem. Sci., 2020, Advance ArticleDOI: 10.1039/D0SC01521K, Edge Article Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Patrick W. Doheny, Jack K. Clegg, Floriana Tuna, David Collison, Cameron J. Kepert, Deanna M. D'AlessandroGaining a fundamental understanding of charge transfer mechanisms in three-dimensional Metal–Organic Frameworks (MOFs) is crucial to the development of electroactive and conductive porous materials.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
single Not a single suspected COVID-19 case missing: Punjab govt By www.newkerala.com Published On :: Thu, 19 Mar 2020 08:10:01 +0530 Full Article
single 11 test positive in Chandigarh, highest single-day spike By www.newkerala.com Published On :: Wed, 29 Apr 2020 08:21:01 +0530 Full Article
single Punjab sees 105 more Covid-19 cases in highest single-day spike By www.newkerala.com Published On :: Fri, 01 May 2020 08:13:02 +0530 Full Article
single Navi Mumbai records highest single-day surge in cases By www.thehindu.com Published On :: Sun, 10 May 2020 01:10:28 +0530 PMC to allow commercial establishments to open shutters on specific days Full Article Mumbai
single X-ray absorption linear dichroism at the Ti K-edge of rutile (001) TiO2 single crystal By scripts.iucr.org Published On :: 2020-02-14 X-ray absorption linear dichroism of rutile TiO2 at the Ti K-edge provides information about the electronic states involved in the pre-edge transitions. Here, linear dichroism with high energy resolution is analyzed in combination with ab initio finite difference method calculations and spherical tensor analysis. It provides an assignment of the three pre-edge peaks beyond the octahedral crystal field splitting approximation and estimates the spatial extension of the corresponding final states. It is then discussed for the first time the X-ray absorption (XAS) of pentacoordinated titanium atoms due to oxygen vacancies and it is found that, similarly to anatase TiO2, rutile is expected to exhibit a transition on the low-energy side of peak A3. Its apparent absence in the experiment is related to the degree of p–d orbital mixing which is small in rutile due to its centrosymmetric point group. A recent XAS linear dichroism study on anatase TiO2 single crystals has shown that peak A2 has an intrinsic origin and is due to a quadrupolar transition to the 3d energy levels. In rutile, due to its centrosymmetric point group, the corresponding peak A2 has a small dipole moment explaining the weak transition. The results are confronted with recent picosecond X-ray absorption spectroscopy on rutile TiO2 nanoparticles. Full Article text
single Structure of a single-chain H2A/H2B dimer By scripts.iucr.org Published On :: 2020-04-28 Chromatin is the complex assembly of nucleic acids and proteins that makes up the physiological form of the eukaryotic genome. The nucleosome is the fundamental repeating unit of chromatin, and is composed of ∼147 bp of DNA wrapped around a histone octamer formed by two copies of each core histone: H2A, H2B, H3 and H4. Prior to nucleosome assembly, and during histone eviction, histones are typically assembled into soluble H2A/H2B dimers and H3/H4 dimers and tetramers. A multitude of factors interact with soluble histone dimers and tetramers, including chaperones, importins, histone-modifying enzymes and chromatin-remodeling enzymes. It is still unclear how many of these proteins recognize soluble histones; therefore, there is a need for new structural tools to study non-nucleosomal histones. Here, a single-chain, tailless Xenopus H2A/H2B dimer was created by directly fusing the C-terminus of H2B to the N-terminus of H2A. It is shown that this construct (termed scH2BH2A) is readily expressed in bacteria and can be purified under non-denaturing conditions. A 1.31 Å resolution crystal structure of scH2BH2A shows that it adopts a conformation that is nearly identical to that of nucleosomal H2A/H2B. This new tool is likely to facilitate future structural studies of many H2A/H2B-interacting proteins. Full Article text
single Rubidium tetrafluoridobromate(III): redetermination of the crystal structure from single-crystal X-ray diffraction data By scripts.iucr.org Published On :: 2019-11-29 Single crystals of rubidium tetrafluoridobromate(III), RbBrF4, were grown by melting and recrystallizing RbBrF4 from its melt. This is the first determination of the crystal structure of RbBrF4 using single-crystal X-ray diffraction data. We confirmed that the structure contains square-planar [BrF4]− anions and rubidium cations that are coordinated by F atoms in a square-antiprismatic manner. The compound crystallizes in the KBrF4 structure type. Atomic coordinates and bond lengths and angles were determined with higher precision than in a previous report based on powder X-ray diffraction data [Ivlev et al. (2015). Z. Anorg. Allg. Chem. 641, 2593–2598]. Full Article text
single Redetermination of the crystal structure of caesium tetrafluoridobromate(III) from single-crystal X-ray diffraction data By scripts.iucr.org Published On :: 2020-01-31 Caesium tetrafluoridobromate(III), CsBrF4, was crystallized in form of small blocks by melting and recrystallization. The crystal structure of CsBrF4 was redetermined from single-crystal X-ray diffraction data. In comparison with a previous study based on powder X-ray diffraction data [Ivlev et al. (2013). Z. Anorg. Allg. Chem. 639, 2846–2850], bond lengths and angles were determined with higher precision, and all atoms were refined with anisotropic displacement parameters. It was confirmed that the structure of CsBrF4 contains two square-planar [BrF4]− anions each with point group symmetry mmm, and a caesium cation (site symmetry mm2) that is coordinated by twelve fluorine atoms, forming an anticuboctahedron. CsBrF4 is isotypic with CsAuF4. Full Article text
single Redetermination of the crystal structure of R5Si4 (R = Pr, Nd) from single-crystal X-ray diffraction data By scripts.iucr.org Published On :: 2020-03-10 The crystal structures of praseodymium silicide (5/4), Pr5Si4, and neodymium silicide (5/4), Nd5Si4, were redetermined using high-quality single-crystal X-ray diffraction data. The previous structure reports of Pr5Si4 were only based on powder X-ray diffraction data [Smith et al. (1967). Acta Cryst. 22 940–943; Yang et al. (2002b). J. Alloys Compd. 339, 189–194; Yang et al., (2003). J. Alloys Compd. 263, 146–153]. On the other hand, the structure of Nd5Si4 has been determined from powder data [neutron; Cadogan et al., (2002). J. Phys. Condens. Matter, 14, 7191–7200] and X-ray [Smith et al. (1967). Acta Cryst. 22 940–943; Yang et al. (2002b). J. Alloys Compd. 339, 189–194; Yang et al., (2003). J. Alloys Compd. 263, 146–153] and single-crystal data with isotropic atomic displacement parameters [Roger et al., (2006). J. Alloys Compd. 415, 73–84]. In addition, the anisotropic atomic displacement parameters for all atomic sites have been determined for the first time. These compounds are confirmed to have the tetragonal Zr5Si4-type structure (space group: P41212), as reported previously (Smith et al., 1967). The structure is built up by distorted body-centered cubes consisting of Pr(Nd) atoms, which are linked to each other by edge-sharing to form a three-dimensional framework. This framework delimits zigzag channels in which the silicon dimers are situated. Full Article text
single The crystal structures of Fe-bearing MgCO3 sp2- and sp3-carbonates at 98 GPa from single-crystal X-ray diffraction using synchrotron radiation By scripts.iucr.org Published On :: 2020-04-21 The crystal structure of MgCO3-II has long been discussed in the literature where DFT-based model calculations predict a pressure-induced transition of the carbon atom from the sp2 to the sp3 type of bonding. We have now determined the crystal structure of iron-bearing MgCO3-II based on single-crystal X-ray diffraction measurements using synchrotron radiation. We laser-heated a synthetic (Mg0.85Fe0.15)CO3 single crystal at 2500 K and 98 GPa and observed the formation of a monoclinic phase with composition (Mg2.53Fe0.47)C3O9 in the space group C2/m that contains tetrahedrally coordinated carbon, where CO44− tetrahedra are linked by corner-sharing oxygen atoms to form three-membered C3O96− ring anions. The crystal structure of (Mg0.85Fe0.15)CO3 (magnesium iron carbonate) at 98 GPa and 300 K is reported here as well. In comparison with previous structure-prediction calculations and powder X-ray diffraction data, our structural data provide reliable information from experiments regarding atomic positions, bond lengths, and bond angles. Full Article text
single Accurate high-resolution single-crystal diffraction data from a Pilatus3 X CdTe detector By scripts.iucr.org Published On :: 2020-04-23 Hybrid photon-counting detectors are widely established at third-generation synchrotron facilities and the specifications of the Pilatus3 X CdTe were quickly recognized as highly promising in charge-density investigations. This is mainly attributable to the detection efficiency in the high-energy X-ray regime, in combination with a dynamic range and noise level that should overcome the perpetual problem of detecting strong and weak data simultaneously. These benefits, however, come at the expense of a persistent problem for high diffracted beam flux, which is particularly problematic in single-crystal diffraction of materials with strong scattering power and sharp diffraction peaks. Here, an in-depth examination of data collected on an inorganic material, FeSb2, and an organic semiconductor, rubrene, revealed systematic differences in strong intensities for different incoming beam fluxes, and the implemented detector intensity corrections were found to be inadequate. Only significant beam attenuation for the collection of strong reflections was able to circumvent this systematic error. All data were collected on a bending-magnet beamline at a third-generation synchrotron radiation facility, so undulator and wiggler beamlines and fourth-generation synchrotrons will be even more prone to this error. On the other hand, the low background now allows for an accurate measurement of very weak intensities, and it is shown that it is possible to extract structure factors of exceptional quality using standard crystallographic software for data processing (SAINT-Plus, SADABS and SORTAV), although special attention has to be paid to the estimation of the background. This study resulted in electron-density models of substantially higher accuracy and precision compared with a previous investigation, thus for the first time fulfilling the promise of photon-counting detectors for very accurate structure factor measurements. Full Article text
single X-ray diffraction using focused-ion-beam-prepared single crystals By scripts.iucr.org Published On :: 2020-04-14 High-quality single-crystal X-ray diffraction measurements are a prerequisite for obtaining precise and reliable structure data and electron densities. The single crystal should therefore fulfill several conditions, of which a regular defined shape is of particularly high importance for compounds consisting of heavy elements with high X-ray absorption coefficients. The absorption of X-rays passing through a 50 µm-thick LiNbO3 crystal can reduce the transmission of Mo Kα radiation by several tens of percent, which makes an absorption correction of the reflection intensities necessary. In order to reduce ambiguities concerning the shape of a crystal, used for the necessary absorption correction, a method for preparation of regularly shaped single crystals out of large samples is presented and evaluated. This method utilizes a focused ion beam to cut crystals with defined size and shape reproducibly and carefully without splintering. For evaluation, a single-crystal X-ray diffraction study using a laboratory diffractometer is presented, comparing differently prepared LiNbO3 crystals originating from the same macroscopic crystal plate. Results of the data reduction, structure refinement and electron density reconstruction indicate qualitatively similar values for all prepared crystals. Thus, the different preparation techniques have a smaller impact than expected. However, the atomic coordinates, electron densities and atomic charges are supposed to be more reliable since the focused-ion-beam-prepared crystal exhibits the smallest extinction influences. This preparation technique is especially recommended for susceptible samples, for cases where a minimal invasive preparation procedure is needed, and for the preparation of crystals from specific areas, complex material architectures and materials that cannot be prepared with common methods (breaking or grinding). Full Article text
single A comparative study of single-particle cryo-EM with liquid-nitrogen and liquid-helium cooling By scripts.iucr.org Published On :: 2019-10-22 Radiation damage is the most fundamental limitation for achieving high resolution in electron cryo-microscopy (cryo-EM) of biological samples. The effects of radiation damage are reduced by liquid-helium cooling, although the use of liquid helium is more challenging than that of liquid nitrogen. To date, the benefits of liquid-nitrogen and liquid-helium cooling for single-particle cryo-EM have not been compared quantitatively. With recent technical and computational advances in cryo-EM image recording and processing, such a comparison now seems timely. This study aims to evaluate the relative merits of liquid-helium cooling in present-day single-particle analysis, taking advantage of direct electron detectors. Two data sets for recombinant mouse heavy-chain apoferritin cooled with liquid-nitrogen or liquid-helium to 85 or 17 K were collected, processed and compared. No improvement in terms of resolution or Coulomb potential map quality was found for liquid-helium cooling. Interestingly, beam-induced motion was found to be significantly higher with liquid-helium cooling, especially within the most valuable first few frames of an exposure, thus counteracting any potential benefit of better cryoprotection that liquid-helium cooling may offer for single-particle cryo-EM. Full Article text
single Refinement for single-nanoparticle structure determination from low-quality single-shot coherent diffraction data By scripts.iucr.org Published On :: 2020-01-01 With the emergence of X-ray free-electron lasers, it is possible to investigate the structure of nanoscale samples by employing coherent diffractive imaging in the X-ray spectral regime. In this work, we developed a refinement method for structure reconstruction applicable to low-quality coherent diffraction data. The method is based on the gradient search method and considers the missing region of a diffraction pattern and the small number of detected photons. We introduced an initial estimate of the structure in the method to improve the convergence. The present method is applied to an experimental diffraction pattern of an Xe cluster obtained in an X-ray scattering experiment at the SPring-8 Angstrom Compact free-electron LAser (SACLA) facility. It is found that the electron density is successfully reconstructed from the diffraction pattern with a large missing region, with a good initial estimate of the structure. The diffraction pattern calculated from the reconstructed electron density reproduced the observed diffraction pattern well, including the characteristic intensity modulation in each ring. Our refinement method enables structure reconstruction from diffraction patterns under difficulties such as missing areas and low diffraction intensity, and it is potentially applicable to the structure determination of samples that have low scattering power. Full Article text
single Characterizing crystalline defects in single nanoparticles from angular correlations of single-shot diffracted X-rays By scripts.iucr.org Published On :: 2020-02-19 Characterizing and controlling the uniformity of nanoparticles is crucial for their application in science and technology because crystalline defects in the nanoparticles strongly affect their unique properties. Recently, ultra-short and ultra-bright X-ray pulses provided by X-ray free-electron lasers (XFELs) opened up the possibility of structure determination of nanometre-scale matter with Å spatial resolution. However, it is often difficult to reconstruct the 3D structural information from single-shot X-ray diffraction patterns owing to the random orientation of the particles. This report proposes an analysis approach for characterizing defects in nanoparticles using wide-angle X-ray scattering (WAXS) data from free-flying single nanoparticles. The analysis method is based on the concept of correlated X-ray scattering, in which correlations of scattered X-ray are used to recover detailed structural information. WAXS experiments of xenon nanoparticles, or clusters, were conducted at an XFEL facility in Japan by using the SPring-8 Ångstrom compact free-electron laser (SACLA). Bragg spots in the recorded single-shot X-ray diffraction patterns showed clear angular correlations, which offered significant structural information on the nanoparticles. The experimental angular correlations were reproduced by numerical simulation in which kinematical theory of diffraction was combined with geometric calculations. We also explain the diffuse scattering intensity as being due to the stacking faults in the xenon clusters. Full Article text
single LAT1 (SLC7A5) and CD98hc (SLC3A2) complex dynamics revealed by single-particle cryo-EM By scripts.iucr.org Published On :: 2019-06-28 Solute carriers are a large class of transporters that play key roles in normal and disease physiology. Among the solute carriers, heteromeric amino-acid transporters (HATs) are unique in their quaternary structure. LAT1–CD98hc, a HAT, transports essential amino acids and drugs across the blood–brain barrier and into cancer cells. It is therefore an important target both biologically and therapeutically. During the course of this work, cryo-EM structures of LAT1–CD98hc in the inward-facing conformation and in either the substrate-bound or apo states were reported to 3.3–3.5 Å resolution [Yan et al. (2019), Nature (London), 568, 127–130]. Here, these structures are analyzed together with our lower resolution cryo-EM structure, and multibody 3D auto-refinement against single-particle cryo-EM data was used to characterize the dynamics of the interaction of CD98hc and LAT1. It is shown that the CD98hc ectodomain and the LAT1 extracellular surface share no substantial interface. This allows the CD98hc ectodomain to have a high degree of movement within the extracellular space. The functional implications of these aspects are discussed together with the structure determination. Full Article text
single Flexible workflows for on-the-fly electron-microscopy single-particle image processing using Scipion By scripts.iucr.org Published On :: 2019-10-01 Electron microscopy of macromolecular structures is an approach that is in increasing demand in the field of structural biology. The automation of image acquisition has greatly increased the potential throughput of electron microscopy. Here, the focus is on the possibilities in Scipion to implement flexible and robust image-processing workflows that allow the electron-microscope operator and the user to monitor the quality of image acquisition, assessing very simple acquisition measures or obtaining a first estimate of the initial volume, or the data resolution and heterogeneity, without any need for programming skills. These workflows can implement intelligent automatic decisions and they can warn the user of possible acquisition failures. These concepts are illustrated by analysis of the well known 2.2 Å resolution β-galactosidase data set. Full Article text
single Quantifying redox heterogeneity in single-crystalline LiCoO2 cathode particles By scripts.iucr.org Published On :: 2020-03-13 Active cathode particles are fundamental architectural units for the composite electrode of Li-ion batteries. The microstructure of the particles has a profound impact on their behavior and, consequently, on the cell-level electrochemical performance. LiCoO2 (LCO, a dominant cathode material) is often in the form of well-shaped particles, a few micrometres in size, with good crystallinity. In contrast to secondary particles (an agglomeration of many fine primary grains), which are the other common form of battery particles populated with structural and chemical defects, it is often anticipated that good particle crystallinity leads to superior mechanical robustness and suppressed charge heterogeneity. Yet, sub-particle level charge inhomogeneity in LCO particles has been widely reported in the literature, posing a frontier challenge in this field. Herein, this topic is revisited and it is demonstrated that X-ray absorption spectra on single-crystalline particles with highly anisotropic lattice structures are sensitive to the polarization configuration of the incident X-rays, causing some degree of ambiguity in analyzing the local spectroscopic fingerprint. To tackle this issue, a methodology is developed that extracts the white-line peak energy in the X-ray absorption near-edge structure spectra as a key data attribute for representing the local state of charge in the LCO crystal. This method demonstrates significantly improved accuracy and reveals the mesoscale chemical complexity in LCO particles with better fidelity. In addition to the implications on the importance of particle engineering for LCO cathodes, the method developed herein also has significant impact on spectro-microscopic studies of single-crystalline materials at synchrotron facilities, which is broadly applicable to a wide range of scientific disciplines well beyond battery research. Full Article text
single A single-crystal diamond X-ray pixel detector with embedded graphitic electrodes By scripts.iucr.org Published On :: 2020-03-31 The first experimental results from a new transmissive diagnostic instrument for synchrotron X-ray beamlines are presented. The instrument utilizes a single-crystal chemical-vapour-deposition diamond plate as the detector material, with graphitic wires embedded within the bulk diamond acting as electrodes. The resulting instrument is an all-carbon transmissive X-ray imaging detector. Within the instrument's transmissive aperture there is no surface metallization that could absorb X-rays, and no surface structures that could be damaged by exposure to synchrotron X-ray beams. The graphitic electrodes are fabricated in situ within the bulk diamond using a laser-writing technique. Two separate arrays of parallel graphitic wires are fabricated, running parallel to the diamond surface and perpendicular to each other, at two different depths within the diamond. One array of wires has a modulated bias voltage applied; the perpendicular array is a series of readout electrodes. X-rays passing through the detector generate charge carriers within the bulk diamond through photoionization, and these charge carriers travel to the nearest readout electrode under the influence of the modulated electrical bias. Each of the crossing points between perpendicular wires acts as an individual pixel. The simultaneous read-out of all pixels is achieved using a lock-in technique. The parallel wires within each array are separated by 50 µm, determining the pixel pitch. Readout is obtained at 100 Hz, and the resolution of the X-ray beam position measurement is 600 nm for a 180 µm size beam. Full Article text
single Diffraction-based determination of single-crystal elastic constants of polycrystalline titanium alloys By scripts.iucr.org Published On :: 2019-09-20 Single-crystal elastic constants have been derived by lattice strain measurements using neutron diffraction on polycrystalline Ti-6Al-4V, Ti-6Al-2Sn-4Zr-6Mo and Ti-3Al-8V-6Cr-4Zr-4Mo alloy samples. A variety of model approximations for the grain-to-grain interactions, namely approaches by Voigt, Reuss, Hill, Kroener, de Wit and Matthies, including texture weightings, have been applied and compared. A load-transfer approach for multiphase alloys was also implemented and the results are compared with single-phase data. For the materials under investigation, the results for multiphase alloys agree well with the results for single-phase materials in the corresponding phases. In this respect, all eight elastic constants in the dual-phase Ti-6Al-2Sn-4Zr-6Mo alloy have been derived for the first time. Full Article text
single Combined X-ray and neutron single-crystal diffraction in diamond anvil cells By scripts.iucr.org Published On :: 2020-02-01 It is shown that it is possible to perform combined X-ray and neutron single-crystal studies in the same diamond anvil cell (DAC). A modified Merrill–Bassett DAC equipped with an inflatable membrane filled with He gas has been developed. It can be used on laboratory X-ray and synchrotron diffractometers as well as on neutron instruments. The data processing procedures and a joint structural refinement of the high-pressure synchrotron and neutron single-crystal data are presented and discussed for the first time. Full Article text
single Enhancing the homogeneity of YBa2(Cu1−xFex)3O7−δ single crystals by using an Fe-added Y2O3 crucible via top-seeded solution growth By journals.iucr.org Published On :: This paper reports an Fe-added Y2O3 crucible which is capable of balancing the solution spontaneously and is employed to effectively enhance the homogeneity of YBa2(Cu1−xFex)3O7−δ single crystals. Full Article text
single Significant texture improvement in single-crystalline-like materials on low-cost flexible metal foils through growth of silver thin films By journals.iucr.org Published On :: Single-crystalline-like thin films composed of crystallographically aligned grains are a new prototype of 2D materials developed recently for low-cost and high-performance flexible electronics as well as second-generation high-temperature superconductors. In this work, significant texture improvement in single-crystalline-like materials is achieved through growth of a 330 nm-thick silver layer. Full Article text
single X-ray diffraction using focused-ion-beam-prepared single crystals By journals.iucr.org Published On :: This study demonstrates a new preparation method for single-crystal X-ray diffraction samples using a focused ion beam. The results of the structure determination and electron density maps with differently prepared samples are discussed, to evaluate this new method. Full Article text
single Accurate high-resolution single-crystal diffraction data from a Pilatus3 X CdTe detector By journals.iucr.org Published On :: Detailed analysis of the high-flux deficiencies of pixel-array detectors leads to a protocol for the measurement of structure factors of unprecedented accuracy even for inorganic materials, and this significantly advances the prospects for experimental electron-density investigations. Full Article text
single Measurement of single crystal piezo modulus by the method of diffraction of synchrotron radiation at angles near π By journals.iucr.org Published On :: The diffraction response of a single crystal to electric field measured by X-ray diffraction by angles close to π. Such schemes allow one to determine with high (~ 10–5–10–6) accuracy the relative changes in the lattice constant. Full Article text