Polarized basis sets for accurate calculations of static and dynamic electric properties of molecules

Journal of Computational Chemistry

Volumn 31, Issue 3, 2010, Pages 552-560

  Baranowska, Angelika ^a,b   Sadlej, Andrzej J ^a  

^a NICOLAUS COPERNICUS UNIVERSITY   (Poland)

^b UNIVERSITY OF SANTIAGO DE COMPOSTELA   (Spain)

Author keywords

Ab initio calculations; Electric dipole moment; Electric dipole polarizability; First electric dipole hyperpolarizability; LPolX basis sets; Second electric dipole hyperpolarizability

Indexed keywords

AB INITIO CALCULATIONS; BASIS SETS; ELECTRIC DIPOLE; ELECTRIC DIPOLE POLARIZABILITY; HYPER-POLARIZABILITY;

ELECTRIC DIPOLE MOMENTS; ELECTRIC FIELDS; ELECTRIC NETWORK ANALYSIS; ELECTRIC PROPERTIES; ENGINEERING EXHIBITIONS; MOLECULES; OPTICAL PROPERTIES;

ELECTRIC GENERATORS;

EID: 75649123485     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.21348     Document Type: Article

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