Search results for "CALCULATIONS"

showing 10 items of 468 documents

The CC3 model : An iterative coupled cluster approach including connected triples

1997

An alternative derivation of many-body perturbation theory (MBPT) has been given, where a coupled cluster parametrization is used for the wave function and the method of undetermined Lagrange multipliers is applied to set up a variational coupled cluster energy expression. In this variational formulation, the nth-order amplitudes determine the energy to order 2n+1 and the nth-order multipliers determine the energy to order 2n+2. We have developed an iterative approximate coupled cluster singles, doubles, and triples model CC3, where the triples amplitudes are correct through second order and the singles amplitudes are treated without approximations due to the unique role of singles as appro…

PhysicsMany-body problemsIterative methodIterative methodsGeneral Physics and AstronomyRelaxation (iterative method)Function (mathematics)Perturbation theoryFull configuration interactionUNESCO::FÍSICA::Química físicaPhysics and Astronomy (all)Coupled clusterCoupled cluster calculationsPerturbation theory ; Many-body problems ; Coupled cluster calculations ; Iterative methods ; Wave functions ; Variational techniquesComputational chemistryPerturbation theoryPhysical and Theoretical ChemistryPhysics::Chemical PhysicsWave function:FÍSICA::Química física [UNESCO]ParametrizationWave functionsMathematical physicsVariational techniques
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Translationally invariant treatment of pair correlations in nuclei - II. Tensor correlations

1998

We study the extension of our translationally invariant treatment of few-body nuclear systems to include tensor forces and correlations. It is shown that a direct application of our method is not as successful for realistic V6 interactions as our previous results for V4 potentials suggested. We investigate the cause in detail for the case of $^4$He, and show that a combination of our method with that of Jastrow-correlated wave functions seems to be a lot more powerful, thereby suggesting that for mildly to strongly repulsive forces such a hybrid procedure may be an appropriate description.

PhysicsNuclear and High Energy PhysicsCLOSED-SHELL NUCLEI; MONTE-CARLO CALCULATIONS; MODEL-CALCULATIONS; COORDINATE SPACE; CBF THEORY; POTENTIALS; CLUSTERS; SYSTEMS; STATE; HE-4Nuclear Theory/dk/atira/pure/subjectarea/asjc/3100/3106V6 forcesFOS: Physical sciencesFísicaInvariant (physics)A ≤ 16Translational invarianceNuclear Theory (nucl-th)Tensor correlationsJastrow correlationsWave functionMathematical physics
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Sensitive search for near-symmetric and super-asymmetric fusion-fission of the superheavy element Flerovium (Z=114)

2021

Physics letters / B 820, 136601 (2021). doi:10.1016/j.physletb.2021.136601

PhysicsNuclear and High Energy PhysicsFusionComponent (thermodynamics)FissionProjectilePhysicsQC1-999chemistry.chemical_elementIsotopes of flerovium530FleroviumSuperheavy elementchemistryNuclear fission dynamicsYield (chemistry)Mass spectrumddc:530Atomic physicsNuclear ExperimentMicroscopic model calculations
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Forward hadron production in pA collisions beyond leading order

2017

In this talk, we report our recent progress on pinning down the cause of negativity in the NLO single inclusive hadron production in pA collisions at forward rapidity.

PhysicsNuclear and High Energy PhysicsParticle physicsta114010308 nuclear & particles physicsHadronperturbative calculationsFOS: Physical sciencesNegativity effect01 natural sciencesNuclear physicsHigh Energy Physics - PhenomenologyHigh Energy Physics - Phenomenology (hep-ph)color transparencyfactorization0103 physical sciencesProduction (economics)Color transparencyRapidityPerturbation theory (quantum mechanics)010306 general physicsNuclear and Particle Physics Proceedings
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Experimental evidence for chirality in the odd-A 105Rh

2004

Abstract High-spin states in 105 Rh were populated by the 96 Zr( 13 C, p3n) reaction at beam energies of 51 and 58 MeV, and studied using the EUROBALL IV γ -ray spectrometer and the DIAMANT charged particle array. A pair of nearly degenerate Δ I = 1 three-quasiparticle bands with the same spins and parity have been observed. Comparison of the experimental results with tilted axis cranking calculations confirms the chiral character of the two bands, while arguments based on the excitation of particles within the π g 9 / 2 ν ( h 11 / 2 ) 2 configuration of the yrast band and comparison with the previously observed γ band exclude the other possible interpretations. This is the first experiment…

PhysicsNuclear and High Energy PhysicsSpins010308 nuclear & particles physics[PHYS.NEXP] Physics [physics]/Nuclear Experiment [nucl-ex]Chiral partner bandsYrastDegenerate energy levelsParity (physics)[PHYS.NEXP]Physics [physics]/Nuclear Experiment [nucl-ex]Tilted axis cranking01 natural sciences21.10.Re; 21.60.-n; 23.20.Lv; 27.60.+jCore-quasiparticle coupling calculationsCharged particleThree-quasiparticle configuration0103 physical sciencesQuasiparticleAtomic physics010306 general physicsChirality (chemistry)ExcitationPhysics Letters B
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Update on the b→s anomalies

2019

We present a brief update of our model-independent analyses of the b->s data presented in the articles published in Phys. Rev. D96 (2017) 095034 and Phys. Rev. D98 (2018) 095027 based on new data on R_K by LHCb, on R_{K^*} by Belle, and on B_{s,d}-> mu^+ mu^- by ATLAS.

PhysicsParticle physicsB: semileptonic decay010308 nuclear & particles physicsWilsonlepton: flavor: violationBELLEbranching ratio: ratioATLASLHC-B01 natural sciencesHigh Energy Physics - PhenomenologyBeyond the standard modelstatistical analysis[PHYS.HPHE]Physics [physics]/High Energy Physics - Phenomenology [hep-ph]0103 physical scienceslepton: universality: violationStatistical analysisB: branching rationumerical calculations010306 general physicsPhysical Review D
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Method specific Cholesky decomposition : Coulomb and exchange energies

2008

We present a novel approach to the calculation of the Coulomb and exchange contributions to the total electronic energy in self consistent field and density functional theory. The numerical procedure is based on the Cholesky decomposition and involves decomposition of specific Hadamard product matrices that enter the energy expression. In this way, we determine an auxiliary basis and obtain a dramatic reduction in size as compared to the resolution of identity (RI) method. Although the auxiliary basis is determined from the energy expression, we have complete control of the errors in the gradient or Fock matrix. Another important advantage of this method specific Cholesky decomposition is t…

PhysicsPotential energy functionsBasis (linear algebra)General Physics and AstronomyMinimum degree algorithmUNESCO::FÍSICA::Química físicaPhysics and Astronomy (all)Computational chemistryFock matrixDensity functional theoryHadamard productApplied mathematicsSCF calculationsDensity functional theoryDensity functional theory ; Hadamard matrices ; Potential energy functions ; SCF calculationsHadamard matricesPhysical and Theoretical Chemistry:FÍSICA::Química física [UNESCO]ScalingCholesky decompositionSparse matrix
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New density-independent interactions for nuclear structure calculations

2013

We present a new two-body finite-range and momentum-dependent but density-independent effective interaction, which can be interpreted as a regularized zero-range force. We show that no three-body or density-dependent terms are needed for a correct description of saturation properties in infinite matter, that is, on the level of low-energy density functional, the physical three-body effects can be efficiently absorbed in effective two-body terms. The new interaction gives a very satisfying equation of state of nuclear matter and opens up extremely interesting perspectives for the mean-field and beyond-mean-field descriptions of atomic nuclei.

Physicsnuclear structure calculationsta114[PHYS.NUCL]Physics [physics]/Nuclear Theory [nucl-th]Nuclear TheoryPhysicsQC1-999Nuclear structureFOS: Physical sciencesDensity independentNuclear matterNuclear Theory (nucl-th)Quantum electrodynamicsAtomic nucleusSaturation (chemistry)density-independent interactionsEPJ Web of Conferences
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Use of site symmetry in supercell models of defective crystals: Polarons in CeO2

2017

The authors thank R. Merkle and G. W. Watson for stimulating discussions. E. K. also acknowledges partial financial support from the Russian Science Foundation for the study of charged defects under the project 14-43-00052. A. C. also acknowledges financial support from the University of Latvia Foundation (Arnis Riekstins's "MikroTik" donation). E. K. and D. G. express their gratitude to the High Performance Computer Centre in Stuttgart (HLRS, project DEFTD 12939) for the provided computer facilities whereas R. A. E. thanks the St. Petersburg State University Computer Center for assistance in high-performance calculations.

PhysicspolaronCondensed matter physicssite symmetryGeneral Physics and Astronomy02 engineering and technologyoxygen vacancy021001 nanoscience & nanotechnologyPolaron01 natural sciencesCrystallographic defectSymmetry (physics)Condensed Matter::Materials SciencePerfect crystalLinear combination of atomic orbitalsPosition (vector)Vacancy defect0103 physical sciences:NATURAL SCIENCES:Physics [Research Subject Categories]Wyckoff positionsPhysical and Theoretical Chemistry010306 general physics0210 nano-technologyfirst principles calculationsCeO2
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Observation of inclined EeV air showers with the radio detector of the Pierre Auger Observatory

2018

With the Auger Engineering Radio Array (AERA) of the Pierre Auger Observatory, we have observed the radio emission from 561 extensive air showers with zenith angles between 60 and 84. In contrast to air showers with more vertical incidence, these inclined air showers illuminate large ground areas of several km2 with radio signals detectable in the 30 to 80 MHz band. A comparison of the measured radio-signal amplitudes with Monte Carlo simulations of a subset of 50 events for which we reconstruct the energy using the Auger surface detector shows agreement within the uncertainties of the current analysis. As expected for forward-beamed radio emission undergoing no significant absorption or sc…

Physics::Instrumentation and DetectorsAstronomyengineering01 natural sciencesultra high energy cosmic rayAugerHigh Energy Physics - ExperimentHigh Energy Physics - Experiment (hep-ex)cosmic ray experiments; cosmic rays detectors; ultra high energy cosmic rays; Astronomy and Astrophysics[PHYS.HEXP]Physics [physics]/High Energy Physics - Experiment [hep-ex]Cosmic ray experiments cosmic rays detectors ultra high energy cosmic rays Astronomy and Astrophysics.Absorption (electromagnetic radiation)Physicsradio waveSettore FIS/01 - Fisica SperimentaleDetectorAstrophysics::Instrumentation and Methods for AstrophysicsDETETORESCOSMIC-RAYSAugerobservatoryAmplitudecosmic rays detectorsAstrophysics - Instrumentation and Methods for Astrophysicsnumerical calculations: Monte CarloairAstrophysics::High Energy Astrophysical PhenomenaFOS: Physical sciencescosmic ray experimentultra high energy cosmic rayscascade: electromagneticOptics0103 physical sciencesHigh Energy Physics[PHYS.PHYS.PHYS-INS-DET]Physics [physics]/Physics [physics]/Instrumentation and Detectors [physics.ins-det]cosmic rays detector010306 general physicscosmic ray experiments cosmic rays detectors ultra high energy cosmic raysInstrumentation and Methods for Astrophysics (astro-ph.IM)ZenithAstrophysiquePierre Auger Observatoryshowers: atmosphere010308 nuclear & particles physicsbusiness.industryScatteringhep-exdetector: surfacescatteringAstronomy and AstrophysicsAstronomieAir showerExperimental High Energy PhysicsARRAYHigh Energy Physics::Experimentcosmic ray experimentscosmic ray experiments; cosmic rays detectors; ultra high energy cosmic raysEMISSIONbusinessabsorptionastro-ph.IM
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