Published May 3, 1993 | Version v1
Journal article

Coupled-cluster calculation of the static polarisabilities and hyperpolarisabilities of magnesium

  • 1. Dept. de Fisica, Univ. Federal de Pernambuco, Recife (Brazil)
  • 2. Inst. de Fisica, Univ. de Sao Paulo (Brazil)

Description

The dipole and the quadrupole polarisabilities, the dipole-dipole-quadropole and second dipole hyperpolarisabilities of the magnesium atom are calculated with an extensive basis set by using the coupled-cluster model within the finite-field approximation. At the highest level, the single-reference coupled-cluster double-excitation model corrected to include contributions of single and triple excitations in the so-called CCD+ST (CCD) scheme, the results are 70.89, 810.0, -8.02x103 and 1.00x105 a.u., respectively, in good argeement with previous single-reference low-order perturbation theory results. (orig.)

Additional details

Publishing Information

Journal Title
Physics Letters. A
Journal Volume
176
Journal Issue
1/2
Journal Page Range
p. 105-108.
ISSN
0375-9601
CODEN
PYLAAG

INIS

Country of Publication
Netherlands
Country of Input or Organization
Netherlands
INIS RN
25020207
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS;
Descriptors DEI
DIPOLE MOMENTS; MAGNESIUM; MANY-BODY PROBLEM; PERTURBATION THEORY; POLARIZABILITY
Descriptors DEC
ALKALINE EARTH METALS; ELECTRICAL PROPERTIES; ELEMENTS; METALS; PHYSICAL PROPERTIES