scispace - formally typeset
Search or ask a question

Showing papers by "Indian Institute of Technology Indore published in 2013"


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +1002 moreInstitutions (89)
04 Mar 2013
TL;DR: In this paper, the authors measured the transverse-momentum (p(T)) distributions and yields of pi, K, and p in Pb-Pb collisions at root s(NN) = 2.76 TeV.
Abstract: In this paper measurements are presented of pi(+/-), K-+/-, p, and (p) over bar production at midrapidity (vertical bar y vertical bar < 0.5), in Pb-Pb collisions at root s(NN) = 2.76 TeV as a function of centrality. The measurement covers the transverse-momentum (p(T)) range from 100, 200, and 300 MeV/c up to 3, 3, and 4.6 GeV/c for pi, K, and p, respectively. The measured p(T) distributions and yields are compared to expectations based on hydrodynamic, thermal and recombination models. The spectral shapes of central collisions show a stronger radial flow than measured at lower energies, which can be described in hydrodynamic models. In peripheral collisions, the p(T) distributions are not well reproduced by hydrodynamic models. Ratios of integrated particle yields are found to be nearly independent of centrality. The yield of protons normalized to pions is a factor similar to 1.5 lower than the expectation from thermal models.

485 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +997 moreInstitutions (89)
18 Jan 2013
TL;DR: In this article, the authors measured the centrality of inelastic Pb-Pb collisions at a center-of-mass energy of 2.76 TeV per colliding nucleon pair with ALICE.
Abstract: This publication describes the methods used to measure the centrality of inelastic Pb-Pb collisions at a center-of-mass energy of 2.76 TeV per colliding nucleon pair with ALICE. The centrality is a key parameter in the study of the properties of QCD matter at extreme temperature and energy density, because it is directly related to the initial overlap region of the colliding nuclei. Geometrical properties of the collision, such as the number of participating nucleons and the number of binary nucleon-nucleon collisions, are deduced from a Glauber model with a sharp impact parameter selection and shown to be consistent with those extracted from the data. The centrality determination provides a tool to compare ALICE measurements with those of other experiments and with theoretical calculations.

388 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +963 moreInstitutions (95)
TL;DR: In this paper, the ALICE measurement of K^0_S and Lambda production at midrapidity in Pb-Pb collisions at sqrt(sNN) = 2.76 TeV is presented.
Abstract: The ALICE measurement of K^0_S and {\Lambda} production at mid-rapidity in Pb-Pb collisions at sqrt(sNN) = 2.76 TeV is presented. The transverse momentum (pT) spectra are shown for several collision centrality intervals and in the pT range from 0.4 GeV/c (0.6 GeV/c for {\Lambda}) to 12 GeV/c. The pT dependence of the {\Lambda}/K^0_S ratios exhibits maxima in the vicinity of 3 GeV/c, and the positions of the maxima shift towards higher pT with increasing collision centrality. The magnitude of these maxima increases by almost a factor of three between most peripheral and most central Pb-Pb collisions. This baryon excess at intermediate pT is not observed in pp interactions at sqrt(s) = 0.9 TeV and at sqrt(s) = 7 TeV. Qualitatively, the baryon enhancement in heavy-ion collisions is expected from radial flow. However, the measured pT spectra above 2 GeV/c progressively decouple from hydrodynamical-model calculations. For higher values of pT, models that incorporate the influence of the medium on the fragmentation and hadronization processes describe qualitatively the pT dependence of the {\Lambda}/K^0_S ratio.

274 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +969 moreInstitutions (88)
11 Jul 2013
TL;DR: In this paper, the ALICE detector was used to measure the long-range correlations between trigger particles and various species of charged associated particles (unidentified particles, pions, kaons, protons and antiprotons).
Abstract: Angular correlations between unidentified charged trigger particles and various species of charged associated particles (unidentified particles, pions, kaons, protons and antiprotons) are measured by the ALICE detector in p-Pb collisions at a nucleon-nucleon centre-of-mass energy of 5.02 TeV in the transverse-momentum range 0.3 < p(T) < 4 GeV/c. The correlations expressed as associated yield per trigger particle are obtained in the pseudorapidity range vertical bar n(lab)vertical bar < 0.8. Fourier coefficients are extracted from the long-range correlations projected onto the azimuthal angle difference and studied as a function of p(T) and in intervals of event multiplicity. In high-multiplicity events, the second-order coefficient for protons, 4, is observed to be smaller than that for pions, v(2)(pi), up to about p(T) = 2 GeV/c. To reduce correlations due to jets, the per-trigger yield measured in low-multiplicity events is subtracted from that in high-multiplicity events. A two-ridge structure is obtained for all particle species. The Fourier decomposition of this structure shows that the second-order coefficients for pions and kaons are similar. The v(2)(p) is found to be smaller at low P-T and larger at higher p(T) than v(2)(pi), with a crossing occurring at about 2 GeV/c. This is qualitatively similar to the elliptic-flow pattern observed in heavy-ion collisions. A mass ordering effect at low transverse momenta is consistent with expectations from hydrodynamic model calculations assuming a collectively expanding system. (C) 2013 CERN. Published by Elsevier B.V. All rights reserved.

271 citations


Journal ArticleDOI
E. Abbas, Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3  +1019 moreInstitutions (91)
TL;DR: The ALICE VZERO system, made of two scintillator arrays at asymmetric positions, one on each side of the interaction point, plays a central role in ALICE and is used to monitor LHC beam conditions, to reject beam-induced backgrounds and to measure basic physics quantities such as luminosity, particle multiplicity, centrality and event plane direction as mentioned in this paper.
Abstract: ALICE is an LHC experiment devoted to the study of strongly interacting matter in proton-proton, proton-nucleus and nucleus-nucleus collisions at ultra-relativistic energies. The ALICE VZERO system, made of two scintillator arrays at asymmetric positions, one on each side of the interaction point, plays a central role in ALICE. In addition to its core function as a trigger source, the VZERO system is used to monitor LHC beam conditions, to reject beam-induced backgrounds and to measure basic physics quantities such as luminosity, particle multiplicity, centrality and event plane direction in nucleus-nucleus collisions. After describing the VZERO system, this publication presents its performance over more than four years of operation at the LHC.

271 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +999 moreInstitutions (81)
02 Jan 2013
TL;DR: Measurements of charge-dependent azimuthal correlations with the ALICE detector at the LHC show a clear signal compatible with a charge- dependent separation relative to the reaction plane, which shows little or no collision energy dependence when compared to measurements at RHIC energies.
Abstract: Measurements of charge-dependent azimuthal correlations with the ALICE detector at the LHC are reported for Pb-Pb collisions at root s(NN) = 2.76 TeV. Two- and three-particle charge-dependent azimuthal correlations in the pseudorapidity range vertical bar eta vertical bar < 0.8 are presented as a function of the collision centrality, particle separation in pseudorapidity, and transverse momentum. A clear signal compatible with a charge-dependent separation relative to the reaction plane is observed, which shows little or no collision energy dependence when compared to measurements at RHIC energies. This provides a new insight for understanding the nature of the charge-dependent azimuthal correlations observed at RHIC and LHC energies. DOI: 10.1103/PhysRevLett.110.012301

255 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +959 moreInstitutions (85)
TL;DR: In this paper, the authors measured the azimuthal anisotropic flow coefficients for unidentified charged particles, pions, and (anti-)protons in Pb-Pb collisions at root SNN = 2.76 TeV with the ALICE detector at the Large Hadron Collider.

215 citations


Journal ArticleDOI
TL;DR: The experimental results are presented to show the effectiveness of the proposed method for classification of sleep stages from EEG signals.

193 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +1020 moreInstitutions (88)
TL;DR: The average transverse momentum (p(T)) versus the charged-particle multiplicity N-ch was measured in p-Pb collisions at a collision energy per nucleon-nucleon root S-NN = 5.02 TeV and in pp collisions at collision energies of root s = 0.9, 2.76, and 7 TeV in the kinematic range 0.15 < p(T) < 10.3 with the ALICE apparatus at the LHC.

174 citations


Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +997 moreInstitutions (83)
29 Jan 2013
TL;DR: The ALICE Collaboration has made the first measurement at the LHC of J/psi photoproduction in ultra-peripheral Pb-Pb collisions at root s(NN) = 2.76 TeV as discussed by the authors.
Abstract: The ALICE Collaboration has made the first measurement at the LHC of J/psi photoproduction in ultra-peripheral Pb-Pb collisions at root s(NN) = 2.76 TeV. The J/psi is identified via its dimuon decay in the forward rapidity region with the muon spectrometer for events where the hadronic activity is required to be minimal. The analysis is based on an event sample corresponding to an integrated luminosity of about 55 mu b(-1). The cross section for coherent J/psi production in the rapidity interval -3.6 < y < -2.6 is measured to be d sigma(coh)(J/psi)/dy = 1.00 +/- 0.18(stat)(-0.26)(+0.24)(syst) mb. The result is compared to theoretical models for coherent J/psi production and found to be in good agreement with those models which include nuclear gluon shadowing. (C) 2012 CERN. Published by Elsevier B.V. All rights reserved.

171 citations


Journal ArticleDOI
E. Abbas, Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3  +1008 moreInstitutions (92)
TL;DR: In this article, the first wide-range measurement of the charged particle pseudorapidity density distribution, for different centralities (the 0-5, 5-10, 10-20, and 20-30% most central events) in Pb-Pb collisions at root s(NN) = 2.76 TeV at the LHC was performed using the full coverage of the ALICE detectors, -5.0 < eta < 5.5.

Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +1005 moreInstitutions (85)
TL;DR: In this paper, the transverse momentum distribution of primary charged particles is measured in minimum bias (non-single-diffractive) p + Pb collisions at the ALICE detector at the LHC.
Abstract: The transverse momentum (pT) distribution of primary charged particles is measured in minimum bias (non-single-diffractive) p + Pb collisions at root(NN)-N-s = 5.02 TeV with the ALICE detector at the LHC. The pT spectra measured near central rapidity in the range 0.5< p(T) < 20 GeV/c exhibit a weak pseudorapidity dependence. The nuclear modification factor R-pPb is consistent with unity for p(T) above 2 GeV/c. This measurement indicates that the strong suppression of hadron production at high p(T) observed in Pb + Pb collisions at the LHC is not due to an initial-state effect. The measurement is compared to theoretical calculations. DOI: 10.1103/PhysRevLett.110.082302

Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +1003 moreInstitutions (85)
18 Jan 2013
TL;DR: The measured pseudorapidity density in p+Pb collisions is compared to model predictions and provides new constraints on the description of particle production in high-energy nuclear collisions.
Abstract: The charged-particle pseudorapidity density measured over four units of pseudorapidity in nonsingle-diffractive p + Pb collisions at a center-of-mass energy per nucleon pair root s(NN) = 5.02 TeV is presented. The average value at midrapidity is measured to be 16.81 +/- 0.71 (syst), which corresponds to 2.14 +/- 0.17 (syst) per participating nucleon, calculated with the Glauber model. This is 16% lower than in nonsingle-diffractive pp collisions interpolated to the same collision energy and 84% higher than in d + Au collisions at root s(NN) = 0.2 TeV. The measured pseudorapidity density in p + Pb collisions is compared to model predictions and provides new constraints on the description of particle production in high-energy nuclear collisions. DOI: 10.1103/PhysRevLett.110.032301

Journal ArticleDOI
TL;DR: This is the first work on smart grids, which integrates these two important security components (privacy preserving data aggregation and access control) and the first paper which addresses access control in smart grids.
Abstract: We propose a decentralized security framework for smart grids that supports data aggregation and access control. Data can be aggregated by home area network (HAN), building area network (BAN), and neighboring area network (NAN) in such a way that the privacy of customers is protected. We use homomorphic encryption technique to achieve this. The consumer data that is collected is sent to the substations where it is monitored by remote terminal units (RTU). The proposed access control mechanism uses attribute-based encryption (ABE) which gives selective access to consumer data stored in data repositories and used by different smart grid users. RTUs and users have attributes and cryptographic keys distributed by several key distribution centers (KDC). RTUs send data encrypted under a set of attributes. Since RTUs are maintained in the substations they are well protected in control rooms and are assumed to be trusted. Users can decrypt information provided they have valid attributes. The access control scheme is distributed in nature and does not rely on a single KDC to distribute the keys which makes the approach robust. To the best of our knowledge, ours is the first work on smart grids, which integrates these two important security components (privacy preserving data aggregation and access control) and the first paper which addresses access control in smart grids.

Journal ArticleDOI
TL;DR: In this paper, the authors present a comprehensive study of the die and mold repairing industries and assist the selection of the most appropriate process depending upon the availability of resources with thorough knowledge of the advantages and limitations.

Journal ArticleDOI
TL;DR: The proposed method has provided detection of focal temporal lobe epilepsy with increased accuracy and has been compared to the existing methods for detecting focalporal lobe epilepsy from intracranial EEG signals.
Abstract: Epileptic seizure is generated by abnormal synchronization of neurons of the cerebral cortex of the patients, which is commonly detected by electroencephalograph (EEG) signals. In this paper, the intracranial EEG signals have been used to detect focal temporal lobe epilepsy. This paper presents a new method based on empirical mode decomposition (EMD) of EEG signals for detection of epileptic seizures. The proposed method uses the Hilbert transformation of intrinsic mode functions (IMFs), obtained by EMD process that provides analytic signal representation of IMFs. The instantaneous area measured from the trace of the windowed analytic IMFs of EEG signals provides rules-based detection of focal temporal lobe epilepsy. The experiment results on intracranial EEG signals are included to show the effectiveness of the proposed method for detection of focal temporal lobe epilepsy. The performance evaluation of the proposed method for epileptic seizure detection has performed by computing the sensitivity (SEN), specificity (SPE), positive predictive value (PPV), negative predictive value (NPV) and error rate detection (ERD). The proposed method has been compared to the existing methods for detecting focal temporal lobe epilepsy from intracranial EEG signals. The proposed method has provided detection of focal temporal lobe epilepsy with increased accuracy.

Journal ArticleDOI
P. Adlarson1, W. Augustyniak, W. Bardan2, M. Bashkanov3, Tomasz Bednarski2, F. S. Bergmann4, M. Berłowski, H. Bhatt5, Markus Büscher6, Hans Calén1, H. Clement3, D. Coderre6, D. Coderre7, Eryk Czerwiński2, K. Demmich4, E. Doroshkevich3, R. Engels6, W. Erven6, W. Eyrich8, P. Fedorets6, K. Föhl9, Kjell Fransson1, Frank Goldenbaum6, P. Goslawski4, A. Goswami10, K. Grigoryev6, K. Grigoryev11, C.-O. Gullström1, F. Hauenstein8, Lena Heijkenskjöld1, V. Hejny6, F. Hinterberger12, M. Hodana2, M. Hodana6, Bo Höistad1, A. Jany2, Benedykt R. Jany2, L. Jarczyk2, Tord Johansson1, B. Kamys2, Günter Kemmerling6, Ferdous Khan6, A. Khoukaz4, St. Kistryn2, J. Klaja2, Harald Kleines6, B. Kłos13, M. Krapp8, Wojciech Krzemien2, P. Kulessa14, A. Kupść1, K. Lalwani5, D. Lersch6, L. Li8, B. Lorentz6, A. Magiera2, R. Maier6, Pawel Marciniewski1, B. Mariański, M. Mikirtychiants, H. P. Morsch, Paweł Moskal2, Basanta Kumar Nandi5, Szymon Niedźwiecki2, H. Ohm6, I. Ozerianska2, E. Perez del Rio3, P. Pluciński1, P. Podkopał6, P. Podkopał2, D. Prasuhn6, A. Pricking3, D. Pszczel1, K. Pysz14, A. Pyszniak2, A. Pyszniak1, C. F. Redmer1, James Ritman7, James Ritman6, Ankhi Roy10, Zbigniew Rudy2, S. Sawant5, S. Schadmand6, Alexander Schmidt8, T. Sefzick6, V. Serdyuk15, V. Serdyuk6, N. Shah5, M. Siemaszko13, R. Siudak14, T. Skorodko3, Magdalena Skurzok2, Jerzy Smyrski2, V. Sopov, R. Stassen6, J. Stepaniak, E. Stephan13, G. Sterzenbach6, H. Stockhorst6, H. Ströher6, Antoni Szczurek14, T. Tolba6, A. Trzciński, R. Varma5, P. Vlasov12, G. J. Wagner3, W. Węglorz13, Magnus Wolke1, Aleksandra Wrońska2, P. Wüstner6, P. Wurm6, Akira Yamamoto16, X. Yuan17, L. Yurev15, J. Zabierowski, C. Zheng17, Marcin Zieliński2, W. Zipper13, Jozef Zlomanczuk1, P. Żuprański, M. Żurek2 
TL;DR: In this paper, high-statistics measurements of the basic double-pionic fusion reactions pn = d pi(0)pi(0), pn > 0, pn < 0, and pp = 0.

Journal ArticleDOI
TL;DR: In this article, the effect of epoxy and hydroxyl functionalization on the electronic structure, work function, CBM/VBM position, and optical absorption spectra of GO using density functional theory calculations was investigated.

Journal ArticleDOI
TL;DR: Carbon dots were used as a reducing agent for the synthesis of Pd nanoparticles coated with ultrathin carbon dot shells of ca.
Abstract: Carbon dots were used as a reducing agent for the synthesis of Pd nanoparticles coated with ultrathin carbon dot shells of ca. 4 nm. The resulting composite nanoparticles showed high catalytic activity for the Heck and Suzuki coupling reactions.

Journal ArticleDOI
TL;DR: In this paper, a 2D finite element method with principle of linear elastic fracture mechanics is adopted to carry out crack propagation path studies for gear pair with different contact ratio, and a comparative study has been carried out to reflect the change in the total effective gear mesh stiffness caused by assumed straight line vs. curved crack path approximation for varying crack levels.

Journal ArticleDOI
P. Adlarson1, W. Augustyniak, W. Bardan2, M. Bashkanov3, F. S. Bergmann4, M. Berłowski, Himani Bhatt5, A. Bondar6, Markus Büscher7, Hans Calén1, Izabela Ciepał2, H. Clement3, D. Coderre8, D. Coderre7, Eryk Czerwiński2, K. Demmich4, E. Doroshkevich3, Ralf Engels7, W. Erven7, W. Eyrich9, P. Fedorets7, K. Föhl10, Kjell Fransson1, Frank Goldenbaum7, P. Goslawski4, A. Goswami11, K. Grigoryev7, K. Grigoryev12, C.-O. Gullström1, F. Hauenstein9, Lena Heijkenskjöld1, V. Hejny7, F. Hinterberger13, M. Hodana7, M. Hodana2, Bo Höistad1, A. Jany2, Benedykt R. Jany2, L. Jarczyk2, T. Johansson1, B. Kamys2, Günter Kemmerling7, Ferdous Khan7, A. Khoukaz4, Stanisław Kistryn2, J. Klaja2, Harald Kleines7, Di. Kirillov14, B. Kłos15, M. Krapp9, Wojciech Krzemien2, P. Kulessa16, A. Kupść1, A. Kuzmin6, K. Lalwani5, D. Lersch7, L. Li9, B. Lorentz7, A. Magiera2, R. Maier7, Pawel Marciniewski1, B. Mariański, Ulf-G. Meißner, M. Mikirtychiants, H. P. Morsch, Paweł Moskal2, Basanta Kumar Nandi5, H. Ohm7, I. Ozerianska2, E. Perez del Rio3, N.M. Piskunov14, P. Pluciński1, P. Podkopał7, P. Podkopał2, D. Prasuhn7, A. Pricking3, D. Pszczel1, K. Pysz16, A. Pyszniak2, A. Pyszniak1, C. F. Redmer1, James Ritman8, James Ritman7, Ankhi Roy11, Zbigniew Rudy2, S. Sawant5, S. Schadmand7, Alexander Schmidt9, T. Sefzick7, V. Serdyuk7, V. Serdyuk14, N. Shah5, B. Shwartz6, M. Siemaszko15, R. Siudak16, T. Skorodko3, Magdalena Skurzok2, Jerzy Smyrski2, V. Sopov, Rolf Stassen7, J. Stepaniak, E. Stephan15, G. Sterzenbach7, Hans Stockhorst7, H. Ströher7, Antoni Szczurek16, T. Tolba7, A. Trzcinski, R. Varma5, G. J. Wagner3, W. Wȩglorz15, Andreas Wirzba7, Magnus Wolke1, Aleksandra Wrońska2, P. Wüstner7, P. Wurm7, Akira Yamamoto17, J. Zabierowski, Marcin Zieliński2, W. Zipper15, Jozef Zlomanczuk1, P. Żuprański, M. Żurek2 
TL;DR: The presently world largest data sample for π 0 → γ e + e − decays studies containing nearly 5 × 10 5 events was collected using the WASA detector at COSY as mentioned in this paper.

Journal ArticleDOI
E. Abbas, Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3  +1011 moreInstitutions (91)
TL;DR: In this paper, the authors reported the first measurement of J/psi elliptic flow v(2) in heavy-ion collisions at the LHC using the ALICE detector in Pb-Pb collisions at root s(NN) = 2.76 TeV in the rapidity range 2.5 < y < 4.
Abstract: We report on the first measurement of inclusive J/psi elliptic flow v(2) in heavy-ion collisions at the LHC. The measurement is performed with the ALICE detector in Pb-Pb collisions at root s(NN) = 2.76 TeV in the rapidity range 2.5 < y < 4.0. The dependence of the J/psi v(2) on the collision centrality and on the J/psi transverse momentum is studied in the range 0 <= p(T) < 10 GeV/c. For semicentral Pb-Pb collisions at root s(NN) = 2.76 TeV, an indication of nonzero v(2) is observed with a largest measured value of v(2) = 0.116 +/-0.046(stat) +/- 0.029(syst) for J/psi in the transverse momentum range 2 <= p(T) < 4 GeV/c. The elliptic flow measurement complements the previously reported ALICE results on the inclusive J/psi nuclear modification factor and favors the scenario of a significant fraction of J/psi production from charm quarks in a deconfined partonic phase.

Journal ArticleDOI
TL;DR: In this paper, the authors proposed a cumulative reduction index (CRI) which uses a variable crack intersection angle to study the effect of different gear parameters on total time varying mesh stiffness.

Journal ArticleDOI
TL;DR: In this paper, an experimental methodology based on conventional photo-elasticity technique for computing stress intensity factor (SIF) for cracked spur gear tooth is presented for different single tooth contact position and crack length.

Journal ArticleDOI
TL;DR: In this article, the authors employed density functional theory and the non-equilibrium Green's function method to investigate the transverse conductance properties of the four nucleotides occurring in DNA when located between opposing functionalized graphene electrodes.
Abstract: Graphene nanogaps and nanopores show potential for the purpose of electrical DNA sequencing, in particular because single-base resolution appears to be readily achievable. Here, we evaluated from first principles the advantages of a nanogap setup with functionalized graphene edges. To this end, we employed density functional theory and the non-equilibrium Green’s function method to investigate the transverse conductance properties of the four nucleotides occurring in DNA when located between opposing functionalized graphene electrodes. In particular, we determined the electrical tunneling current variation as a function of the applied bias and analyzed the associated differential conductance at a voltage which appears suitable to distinguish between the four nucleotides. Intriguingly, we predict for one of the nucleotides (deoxyguanosine monophosphate) a negative differential resistance effect.

Journal ArticleDOI
TL;DR: In this article, the synthesis and structural characterization of supraicosahedral rhodaborane clusters are reported, and all the compounds have been characterized by IR, (1)H, (11)B, (13)C NMR spectroscopy in solution, and the solid state structures were established by crystallographic analysis of compounds 1-5.
Abstract: Syntheses and structural characterization of supraicosahedral rhodaborane clusters are reported. Reaction of [(Cp*RhCl2)2], (Cp* = η(5)-C5Me5) with [LiBH4·thf] followed by thermolysis with excess of [BH3·thf] afforded 16-vertex closo-[(Cp*Rh)3B12H12Rh{Cp*RhB4H9}], 1, 15-vertex [(Cp*Rh)2B13H13], 2, 12-vertex [(Cp*Rh)2B10Hn(OH)m], (3a: n = 12, m = 0; 3b: n = 9, m = 1; 3c: n = 8, m = 2) and 10-vertex [(Cp*Rh)3B7H7], 4, and [(Cp*Rh)4B6H6], 5. Cluster 1 is the unprecedented 16-vertex cluster, consists of a sixteen-vertex {Rh4B12} with an exo-polyhedral {RhB4} moiety. Cluster 2 is the first example of a carbon free 15-vertex supraicosahedral metallaborane, exhibits icosihexahedron geometry (26 triangular faces) with three degree-six vertices. Clusters 3a-c have 12-vertex isocloso geometry, different from that of icosahedral one. Clusters 4 and 5 are attributed to the 10-vertex isocloso geometry based on 10-vertex bicapped square antiprism structure. In addition, quantum-chemical calculations with DFT methods at the BP86 level of theory have been used to provide further insight into the electronic structure and stability of the optimized structures which are in satisfactory agreement with the structure determinations. All the compounds have been characterized by IR, (1)H, (11)B, (13)C NMR spectroscopy in solution, and the solid state structures were established by crystallographic analysis of compounds 1-5.

Journal ArticleDOI
TL;DR: In this paper, the authors employed DFT and HSE06 methods to study the doping effects on the NaTaO3 photocatalyst and found that double-hole-mediated codoping can decrease the band gap significantly.
Abstract: In this paper, we have employed DFT and HSE06 methods to study the doping effects on the NaTaO3 photocatalyst. N, S, C, and P monodoping and N–N, C–S, P–P, and N–P codoping have been studied. The redopants’ formation energies have been calculated, and we find S monodoping is energetically more favorable than any other elemental doping. The mechanism of anion doping on the electronic properties of NaTaO3 is discussed. We find the band gap reduces significantly if we dope with anionic elements whose p orbital energy is higher than the O 2p orbitals. N and S can shift the valence band edge upward without losing the ability to split water into H2 and O2. Double-hole-mediated codoping can decrease the band gap significantly. On the basis of our calculations, codoping with N–N, C–S, and P–P could absorb visible light. However, they can only decompose water into H2 when the valence band edge is above the water oxidation level.

Journal ArticleDOI
TL;DR: A cascade process involving an SN2′ reaction and an intramolecular oxa-Michael addition has been developed by treating Morita–Baylis–Hillman acetates of nitroalkenes with arenols, forming arenofurans in good to excellent yield in most cases.

Journal ArticleDOI
TL;DR: In this paper, the authors studied the interface between water and fluoroalkylsilane self-assembled monolayers using specular x-ray reflectivity and analyzed the parameter-space landscapes of the merit functions being minimized by data fitting.
Abstract: The free surface of water and the interface between water and a hydrophobic surface both have positive interface energies. The water density near a free surface drops below the bulk density, and thus it is expected that water near a hydrophobic surface will also show a density depletion. However, efforts by multiple groups to detect and characterize the predicted gap at water-hydrophobic interfaces have produced contradictory results. We have studied the interface between water and fluoroalkylsilane self-assembled monolayers using specular x-ray reflectivity and analyzed the parameter-space landscapes of the merit functions being minimized by data fitting. This analysis yields a better understanding of confidence intervals than the customary process of reporting a unique best fit. We conclude that there are unambiguous gaps at water-hydrophobic interfaces when the hydrophobic monolayer is more densely packed.

Journal ArticleDOI
Betty Abelev1, Jaroslav Adam2, Dagmar Adamová3, Andrew Marshall Adare4  +1012 moreInstitutions (82)
10 Apr 2013
TL;DR: In this paper, the first measurement of the net charge fluctuations in Pb-Pb collisions at s_NN 2.76 TeV was reported with the ALICE detector at the CERN Large Hadron Collider.
Abstract: We report the first measurement of the net-charge fluctuations in Pb-Pb collisions at \surd s_NN 2.76 TeV, measured with the ALICE detector at the CERN Large Hadron Collider. The dynamical fluctuations per unit entropy are observed to decrease when going from peripheral to central collisions. An additional reduction in the amount of fluctuations is seen in comparison to the results from lower energies. We examine the dependence of fluctuations on the pseudo-rapidity interval, which may account for the dilution of fluctuations during the evolution of the system. We find that the ALICE data points are between the theoretically predicted values for a hadron gas and a Quark-Gluon Plasma.