Electron distribution

Listing items with Subject "Electron distribution"

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FormatDateTitleAuthor
FormatDateTitleAuthor
doc icon DUGiDocs 2014 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
out url icon Recercat 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
out url icon Recercat 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
out url icon Recercat 2018 June 1 Benchmark calculations on the lowest-energy singlet, triplet, and quintet states of the four-electron harmonium atom
out url icon Recercat 2018 June 5 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
doc icon DUGiDocs 1996 A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods SolĂ  i Puig, Miquel ; Mestres i LĂłpez, Jordi ; CarbĂł-Dorca, Ramon ; Duran i Portas, Miquel
out url icon Recercat A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods SolĂ  i Puig, Miquel ; Mestres i LĂłpez, Jordi ; CarbĂł-Dorca, Ramon ; Duran i Portas, Miquel
out url icon Recercat 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
doc icon DUGiDocs 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
doc icon DUGiDocs 1997 A quantum molecular similarity analysis of changes in molecular electron density caused by basis set flotation and electric field application Simon i Rabasseda, SĂ­lvia ; Duran i Portas, Miquel
out url icon Recercat A quantum molecular similarity analysis of changes in molecular electron density caused by basis set flotation and electric field application Simon i Rabasseda, SĂ­lvia ; Duran i Portas, Miquel
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