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pro vyhledávání: '"RPA calculations"'
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Publikováno v:
Journal of Chemical Physics
Journal of Chemical Physics, American Institute of Physics, 2011, 134, pp.244514. ⟨10.1063/1.3602469⟩
Journal of Chemical Physics, American Institute of Physics, 2011, 134, pp.244514. ⟨10.1063/1.3602469⟩
We introduce an ultrasoft core model of interpenetrating polycations and polyanions with continuous Gaussian charge distributions, to investigate polyelectrolyte aggregation in dilute and semi-dilute, salt-free solutions. The model is studied by a co
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::168c63589582ddb0e88b3aa0882ea9f1
http://hdl.handle.net/11368/2969183
http://hdl.handle.net/11368/2969183
Publikováno v:
Nuclear Physics A. 563(2):225-246
Double-differential cross sections of the Fe-54,Fe-56(n, p) reactions have been measured at 97 MeV in the angular range 0-30-degrees for excitation energies up to 40 MeV. The spectra have been decomposed into different multipolarities by a technique
Publikováno v:
Journal of Chemical Physics
Journal of Chemical Physics, American Institute of Physics, 2010, 133 (6), pp.064105. ⟨10.1063/1.3461163⟩
Journal of Chemical Physics, American Institute of Physics, 2010, 133 (6), pp.064105. ⟨10.1063/1.3461163⟩
International audience; An algorithm for the solution of the linear response equation in the random phase approximation is presented. All entities including frequency arguments, matrices, and vectors, are assumed to be complex, and it represents the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::99fb41e532e902b4b1dd6148b9266b13
https://hal.archives-ouvertes.fr/hal-00760979/document
https://hal.archives-ouvertes.fr/hal-00760979/document
Autor:
Stefano de Gironcoli, Huy-Viet Nguyen
Publikováno v:
Physical review. B, Condensed matter and materials physics 79 (2009): 205114. doi:10.1103/PhysRevB.79.205114
info:cnr-pdr/source/autori:Nguyen, Huy-Viet; de Gironcoli, Stefano/titolo:Efficient calculation of exact exchange and RPA correlation energies in the adiabatic-connection fluctuation-dissipation theory/doi:10.1103%2FPhysRevB.79.205114/rivista:Physical review. B, Condensed matter and materials physics/anno:2009/pagina_da:205114/pagina_a:/intervallo_pagine:205114/volume:79
info:cnr-pdr/source/autori:Nguyen, Huy-Viet; de Gironcoli, Stefano/titolo:Efficient calculation of exact exchange and RPA correlation energies in the adiabatic-connection fluctuation-dissipation theory/doi:10.1103%2FPhysRevB.79.205114/rivista:Physical review. B, Condensed matter and materials physics/anno:2009/pagina_da:205114/pagina_a:/intervallo_pagine:205114/volume:79
Recently there has been a renewed interest in the calculation of exact-exchange and RPA correlation energies for realistic systems. These quantities are main ingredients of the so-called EXX/RPA+ scheme which has been shown to be a promising alternat
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::dbc4d94fa740d4a4bbf44397993299b4
http://arxiv.org/abs/0902.0889
http://arxiv.org/abs/0902.0889
Publikováno v:
Physical review / B 80(18), 184403 (2009). doi:10.1103/PhysRevB.80.184403
The magnetic state of nitrogen-doped MgO, with N substituting O at concentrations between 1% and the concentrated limit, is calculated with density-functional methods. The N atoms are found to be spin polarized with a moment of $1{\ensuremath{\mu}}_{
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0808c2d4db57edb807452bf69f9ecc6b
https://hdl.handle.net/2128/11019
https://hdl.handle.net/2128/11019
Publikováno v:
Physical Review B: Condensed Matter and Materials Physics
We evaluate the stopping and image forces on a charged particle moving parallel to a doped sheet of graphene by using the dielectric response formalism for graphene's $\pi$-electron bands in the random phase approximation (RPA). The forces are presen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::36c2f2d11bb0cc23718167e05f96b8e6
https://vinar.vin.bg.ac.rs/handle/123456789/3838
https://vinar.vin.bg.ac.rs/handle/123456789/3838
Autor:
Becheva, E., Blumenfeld, Y., Khan, E., Beaumel, D., Daugas, J.M., Delaunay, F., Demonchy, C.E., Drouart, A., Fallot, Muriel, Gillibert, A., Giot, Lydie, Grasso, M., Keeley, N., W. Kemper, K., T. Khoa, D., Lapoux, V., Lima, V., Musumarra, A., Nalpas, L., C. Pollacco, E., Roig, O., Roussel-Chomaz, P., E. Sauvestre, J., A. Scarpaci, J., Skaza, F., Than, H. S.
Publikováno v:
Physical Review Letters
Physical Review Letters, American Physical Society, 2006, 96, pp.012501. ⟨10.1103/PhysRevLett.96.012501⟩
Physical Review Letters, 2006, 96, pp.012501. ⟨10.1103/PhysRevLett.96.012501⟩
Physical Review Letters, American Physical Society, 2006, 96, pp.012501. ⟨10.1103/PhysRevLett.96.012501⟩
Physical Review Letters, 2006, 96, pp.012501. ⟨10.1103/PhysRevLett.96.012501⟩
NESTER PTH; International audience; To investigate the behavior of the N=14 neutron gap far from stability with a neutron-sensitive probe, proton elastic and 2+1 inelastic scattering angular distributions for the neutron-rich nucleus 22O were measure
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::37d9d6c9f23ce26cbda0094bad6bac67
http://hal.in2p3.fr/in2p3-00025255/file/paperO22.pdf
http://hal.in2p3.fr/in2p3-00025255/file/paperO22.pdf