Reexamination of the interaction of atoms with a LiF(001) surface

Pairwise additive potentials for multielectronic atoms interacting with a LiF(001) surface are revisited by including an improved description of the electron density associated with the different lattice sites, as well as nonlocal electron density contributions. Within this model, the electron distr...

Descripción completa

Guardado en:

Detalles Bibliográficos
Autores principales:	Miraglia, J.E., Gravielle, M.S.
Formato:	JOUR
Materias:	Atoms Carrier concentration Electron density measurement Electrons Van der Waals forces Density contribution Electron distributions Grazing incidence Interaction potentials Interatomic potential Madelung potential Nonlocal functionals Van der Waals contribution Lattice vibrations
Acceso en línea:	http://hdl.handle.net/20.500.12110/paper_24699926_v95_n2_p_Miraglia
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

Ejemplares similares

Reexamination of the interaction of atoms with a LiF(001) surface
por: Miraglia, Jorge Esteban, et al.
Publicado: (2017)

Van der Waals effects on grazing-incidence fast-atom diffraction for H on LiF(001)
por: Bocan, G.A., et al.

Van der Waals effects on grazing-incidence fast-atom diffraction for H on LiF(001)
Publicado: (2016)

Van der Waals effects in GIFAD for light atoms on insulating surfaces
por: Bocan, G.A., et al.

Van der Waals effects in GIFAD for light atoms on insulating surfaces
Publicado: (2017)

Relative influence of noncovalent interactions on the melting points of a homologous series of 1,2-dibromo- 4,5-dialkoxybenzenes
por: Cecchi, Florencia, et al.
Publicado: (2013)

Relative influence of noncovalent interactions on the melting points of a homologous series of 1,2-dibromo- 4,5-dialkoxybenzenes
por: Fonrouge, A., et al.
Publicado: (2013)

Relative influence of noncovalent interactions on the melting points of a homologous series of 1,2-dibromo- 4,5-dialkoxybenzenes
por: Fonrouge, A., et al.

Relative influence of noncovalent interactions on the melting points of a homologous series of 1,2-dibromo- 4,5-dialkoxybenzenes
por: Fonrouge, A., et al.
Publicado: (2013)

por: Núñez Regueiro, M., et al.
Publicado: (1993)

Multilayer approximation for a confined fluid in a slit pore
por: Zarragoicoechea, Guillermo Jorge, et al.
Publicado: (2010)

Trasnsferencia de hidrógeno en moléculas de interés biológico : estudios en complejos de van der Waals
por: Oldani, Andrés Nicolás
Publicado: (2025)

Termodinámica: Ecuaciones de estado I
por: Calderón, Lisandro

The electrochemical stability of thiols on gold surfaces
por: Salvarezza, Roberto Carlos, et al.
Publicado: (2018)

Electronic structure and properties of NbS2 and TiS2 low dimensional structures
por: Llois, Ana María
Publicado: (2012)

Electronic structure and properties of NbS2 and TiS2 low dimensional structures
por: Güller, F., et al.

El Legado de van der Waals : Su tesis a 100 A�nos del Premio Nobel /
por: Valderrama, Jos�e O.
Publicado: (2010)

Br⋯Br and van der Waals interactions along a homologous series: Crystal packing of 1,2-dibromo-4,5-dialkoxybenzenes
por: Suarez, Sebastian, et al.
Publicado: (2016)

Br⋯Br and van der Waals interactions along a homologous series: Crystal packing of 1,2-dibromo-4,5-dialkoxybenzenes
por: Suarez, S.A., et al.

Electrostatic complementarity in an aldose reductase complex from ultra-high-resolution crystallography and first-principles calculations
por: Muzet, Nicolas, et al.
Publicado: (2003)

Comparison of halogen bonding and van der Waals and π-π Inter-actions in 4,5-dibromo-2-hexyl-oxyphenol
por: Cukiernik, Fabio Daniel, et al.
Publicado: (2009)

Comparison of halogen bonding and van der Waals and π-π Inter-actions in 4,5-dibromo-2-hexyl-oxyphenol
por: Cukiernik, F.D., et al.

Self organization in oleic acid-coated CoFe₂O₄ colloids: a SAXS study
por: Fernández van Raap, Marcela Beatriz, et al.
Publicado: (2012)

Implicancias de las interacciones no covalentes en la dinámica de colisiones entre el radical OH y alcoholes
por: Hernández, Federico J.
Publicado: (2020)

Ab initio potential for the He-Ag(110) interaction investigated using grazing-incidence fast-atom diffraction
por: Rubiano, C.A.R., et al.

Interaction potentials for multi-electron atoms in front of a LiF (0 0 1) surface from rainbow scattering
por: Gravielle, M.S., et al.

Photoelectron emission from LiF surfaces by ultrashort pulses
por: Acuña, M., et al.

Ab initio potential for the He-Ag(110) interaction investigated using grazing-incidence fast-atom diffraction
Publicado: (2013)

Time-dependent induced potentials in convoy electron emission
por: Miraglia, Jorge Esteban
Publicado: (2006)

Photoelectron emission from LiF surfaces by ultrashort electromagnetic pulses
por: Gravielle, Maria Silvia
Publicado: (2011)

Time-dependent induced potentials in convoy electron emission
por: Acuña, G.P., et al.

Photoelectron emission from LiF surfaces by ultrashort electromagnetic pulses
por: Acuña, M.A., et al.

Photoelectron emission from LiF surfaces by ultrashort pulses
Publicado: (2012)

Interaction potentials for multi-electron atoms in front of a LiF (0 0 1) surface from rainbow scattering
Publicado: (2013)

The structure of the bulk and the (001) surface of V2O5: a DFT+U study
por: Ranea, Víctor Alejandro, et al.
Publicado: (2016)

Grand-canonical-ensemble representability problem for the one-electron reduced density matrix
por: Bochicchio, Roberto Carlos
Publicado: (2007)

Grand-canonical-ensemble representability problem for the one-electron reduced density matrix
por: Alcoba, D.R., et al.

Total electron yields and stopping power of protons colliding with NaCl-type insulator surfaces
por: García, A.J., et al.

Frits van der Berghe 1883-1939 : catalogue raisonné de son oeuvre peint
por: Langhi, Emile
Publicado: (1966)

Otras vías : Pikionis, Lewerentz, Van der Laan /
Publicado: (2011)