DUGi: Llistar Títols | Electron distribution

Llistar Títols per Matèria "Electron distribution"

S'han trobat 19 ítems

Llistant ítems des de 0 a 19:

Format	Data	Títol	Autor
Format	Data	Títol	Autor
		Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom	Cioslowski, Jerzy ; Strasburger, Krzysztof ; Matito i Gras, Eduard
		Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom	Cioslowski, Jerzy ; Strasburger, Krzysztof ; Matito i Gras, Eduard
	1 juny 2018	Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom
	5 juny 2018	Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom	Cioslowski, Jerzy ; Strasburger, Krzysztof ; Matito i Gras, Eduard
		Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom	Cioslowski, Jerzy ; Strasburger, Krzysztof ; Matito i Gras, Eduard
	2002	A chemical Hamiltonian approach study of the basis set superposition error changes on electron densities and one- and two-center energy components	Salvador Sedano, Pedro ; Duran i Portas, Miquel ; Fradera i Llinàs, Xavier
	15 febrer 2020	A chemical Hamiltonian approach study of the basis set superposition error changes on electron densities and one- and two-center energy components	Salvador Sedano, Pedro ; Duran i Portas, Miquel ; Fradera i Llinàs, Xavier
	1996	A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods	Solà i Puig, Miquel ; Mestres i López, Jordi ; Carbó-Dorca, Ramon ; Duran i Portas, Miquel
		A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods	Solà i Puig, Miquel ; Mestres i López, Jordi ; Carbó-Dorca, Ramon ; Duran i Portas, Miquel
	15 febrer 2020	A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods	Solà i Puig, Miquel ; Mestres i López, Jordi ; Carbó-Dorca, Ramon ; Duran i Portas, Miquel
	5 desembre 2016	Correlation energy, correlated electron density, and exchange-correlation potential in some spherically confined atoms	Vyboishchikov, Sergei F.
	15 febrer 2020	Effect of basis set superposition error on the electron density of molecular complexes	Salvador Sedano, Pedro ; Fradera i Llinàs, Xavier ; Duran i Portas, Miquel
		Electron Localization Function at the Correlated Level: A Natural Orbital Formulation	Feixas Geronès, Ferran ; Matito i Gras, Eduard ; Duran i Portas, Miquel ; Solà i Puig, Miquel ; Silvi, Bernard
	2010	Electron Localization Function at the Correlated Level: A Natural Orbital Formulation	Feixas Geronès, Ferran ; Matito i Gras, Eduard ; Duran i Portas, Miquel ; Solà i Puig, Miquel ; Silvi, Bernard
	15 febrer 2020	The electron-pair density distribution of the 1,3Πu excited states of H2	Mercero, J. M. ; Rodríguez-Mayorga, M. ; Rodríguez Mayorga, Mauricio ; Matito i Gras, Eduard ; Lopez, Xabier ; Ugalde, Jesus M.
	10 juliol 2016	The electron-pair density distribution of the 1,3Πu excited states of H2	Mercero, Jose M. ; Rodríguez-Mayorga, M. ; Rodríguez Mayorga, Mauricio ; Matito i Gras, Eduard ; Lopez, Xabier ; Ugalde, Jesús M.
	1997	A quantum molecular similarity analysis of changes in molecular electron density caused by basis set flotation and electric field application	Simon i Rabasseda, Sílvia ; Duran i Portas, Miquel
		A quantum molecular similarity analysis of changes in molecular electron density caused by basis set flotation and electric field application	Simon i Rabasseda, Sílvia ; Duran i Portas, Miquel
	15 febrer 2020	The relevance of the Laplacian of intracule and extracule density distributions for analyzing electron-electron interactions in molecules	Fradera i Llinàs, Xavier ; Duran i Portas, Miquel ; Mestres i López, Jordi

DUGi

Portal de cerca conjunta als documents digitals de la UdG

Llistar Títols per Matèria "Electron distribution"

Matèries

Autors