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Multi-dimensional constrained covariant density functional theories were developed recently. In these theories, all shape degrees of freedom \beta_{\lambda\mu} deformations with even \mu are allowed, e.g., \beta_{20}, \beta_{22},…

Nuclear Theory · Physics 2013-03-05 Bing-Nan Lu , Jie Zhao , En-Guang Zhao , Shan-Gui Zhou

New energy-density functionals (EDFs) inspired by effective-field theories (EFTs) have been recently proposed. The present work focuses on three of such functionals which were developed to produce satisfactory equations of state for nuclear…

Nuclear Theory · Physics 2018-09-26 Jérémy Bonnard , Marcella Grasso , Denis Lacroix

The parametrization D1M of the Gogny energy density functional is used to study fission in the odd-mass Uranium and Plutonium isotopes with A=233,\ldots,249 within the framework of the Hartree-Fock-Bogoliubov (HFB) Equal Filling…

Nuclear Theory · Physics 2017-12-29 R. Rodríguez-Guzmán , L. M. Robledo

We discuss the octupole deformation properties of the recently proposed Barcelona-Catania-Paris (BCP) energy density functionals for two sets of isotopes, those of radium and barium, where it is believed that octupole deformation plays a…

Nuclear Theory · Physics 2010-04-14 L. M. Robledo , M. Baldo , P. Schuck , X. Viñas

We have developed multi-dimensional constrained covariant density functional theories (MDC-CDFT) for finite nuclei in which the shape degrees of freedom \beta_{\lambda\mu} with even \mu, e.g., \beta_{20}, \beta_{22}, \beta_{30}, \beta_{32},…

Nuclear Theory · Physics 2014-10-23 Bing-Nan Lu , Jie Zhao , En-Guang Zhao , Shan-Gui Zhou

Deformed Hartree-Fock-Bogoliubov calculations for finite nuclei are carried out. As residual interaction, a Brueckner G-matrix derived from a meson-exchange potential is taken. Phenomenological medium modifications of the meson masses are…

Nuclear Theory · Physics 2009-10-30 F. Gruemmer , B. Q. Chen , Z. Y. Ma , S. Krewald

The most recent parametrizations D1S, D1N and D1M of the Gogny energy density functional are used to describe fission in the isotopes $^{232-280}$ U. Fission paths, collective masses and zero point quantum corrections, obtained within the…

Nuclear Theory · Physics 2014-05-27 R. Rodriguez-Guzman , L. M. Robledo

Surface properties of neutron-neutron (T=1) pairing in semi-infinite nuclear matter in a hard wall potential are investigated in BCS approximation using the Gogny force. Surface enhancement of the gap function, pairing tensor and…

Nuclear Theory · Physics 2009-10-31 M. Farine , P. Schuck

The systematic investigation of the ground state and fission properties of even-even actinides and superheavy nuclei with $Z=90-120$ from the two-proton up to two-neutron drip lines with proper assessment of systematic theoretical…

Nuclear Theory · Physics 2021-03-09 A. Taninah , S. E. Agbemava , A. V. Afanasjev

Properties of hcp-Ti such as elastic constants, stacking faults and gamma-surfaces are computed using Density Functional Theory (DFT) and two central force Embedded Atom interaction Models (EAM). The results are compared to previously…

Materials Science · Physics 2015-06-05 Magali Benoit , Nathalie Tarrat , Joseph Morillo

We calculate properties like equilibrium lattice parameter, bulk modulus and monovacancy formation energy for nickel (Ni), iron (Fe) and chromium (Cr) using Kohn-Sham density functional theory (DFT). We compare relative performance of local…

Materials Science · Physics 2011-09-15 Prithwish Kumar Nandi , M. C. Valsakumar , Sharat Chandra , H. K. Sahu , C. S. Sundar

Deformed and spherical even-even nuclei are studied using a finite range simple effective interaction within the Hartree-Fock-Bogoliubov mean field approach. Different parameter sets of the interaction, corresponding to different…

Nuclear Theory · Physics 2017-04-13 B. Behera , X. Viñas , T. R. Routray , L. M. Robledo , M. Centelles , S. P. Pattnaik

Detailed physisorption data from experiment for the H_2 molecule on low-index Cu surfaces challenge theory. Recently, density-functional theory (DFT) has been developed to account for nonlocal correlation effects, including van der Waals…

Covariant density functional theory (CDFT) is a modern theoretical tool for the description of nuclear structure phenomena. The current investigation aims at the global assessment of the accuracy of the description of the ground state…

Nuclear Theory · Physics 2015-06-19 S. E. Agbemava , A. V. Afanasjev , D. Ray , P. Ring

The interacting boson-fermion model (IBFM), with parameters determined from the microscopic Hartree-Fock-Bogoliubov (HFB) approximation, based on the parametrization D1M of the Gogny energy density functional (EDF), is employed to study the…

Nuclear Theory · Physics 2017-12-27 K. Nomura , R Rodríguez-Guzmán , L. M. Robledo

Valuable theoretical predictions of nuclear dipole excitations in the whole chart are of great interest for different nuclear applications, including in particular nuclear astrophysics. Here we present large-scale calculations of the $E1$…

Nuclear Theory · Physics 2016-07-29 M. Martini , S. Péru , S. Hilaire , S. Goriely , F. Lechaftois

We present a comprehensive study of low-lying states in even-even Ne, Mg, Si, S, Ar isotopes with the multireference density functional theory (MR-DFT) based on a relativistic point-coupling energy density functional (EDF). Beyond…

Nuclear Theory · Physics 2015-12-09 Xian-Ye Wu , Xian-Rong Zhou

A combined density and first-order reduced-density-matrix (1RDM) functional method is proposed for the calculation of potential energy curves (PECs) of molecular multibond dissociation. Its 1RDM functional part, a pair density functional,…

Chemical Physics · Physics 2020-09-23 Robert van Meer , Oleg Gritsenko , Jeng-Da Chai

The analytical expression of the density-dependent binding energy per nucleon for the relativistic mean field (RMF), also known as the relativistic energy density functional (Relativistic-EDF), is used to obtain the isospin-dependent…

Nuclear Theory · Physics 2024-08-30 Praveen K. Yadav , Raj Kumar , M. Bhuyan

We have calculated the three-dimensional potential energy surface (PES) for the fission of compound nucleus $^{236}$U using the covariant density functional theory with constraints on the axial quadrupole and octupole deformations…

Nuclear Theory · Physics 2023-05-30 Ming-Hui Zhou , Ze-Yu Li , Sheng-Yuan Chen , Yong-Jing Chen , Zhi-Pan Li