Author Institution: Department of Chemistry, Southern Illinois UniversityThe purpose of the investigation is to determine the behavior of a single type of variational parameter as the basis function becomes more complex. The molecule used for an example is $He_{2}^{+}$. The basis function is made more complex by successively considering one, two, and three different orbital exponents. The variation is performed at all values of the internuclear distance, in contrast to previous work which had been done only at the equilibrium internuclear distance. For comparison purposes, a variational-perturbation calculation is also performed on $He_{2}^{+}$
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
Extensive variational computations are reported for the ground state energy of the non-relativistic ...
Calculations are performed on the \S <:Jd ground states of d ' + the H and HC) molecules using a b...
Extensive variational computations are reported for the ground state energy of the non-relativi...
Extensive variational computations are reported for the ground state energy of the non-relativi...
The variational-perturbation method is applied to the study of angular correlations between electron...
Author Institution: Department of Chemistry, Southern Illinois UniversityThe use of a single orbital...
In the first part of this work, a distribution function P(012) for the interelectronic angle in atom...
$^{*}$Supported by the United States Air Force OSR and National Science FoundationAuthor Institution...
In the first part of this work, a distribution function P(012) for the interelectronic angle in atom...
$^{*}$Supported by the United States Air Force OSR and National Science FoundationAuthor Institution...
$^{*}$This work assisted by a grant from the National Science Foundation with The University of Chic...
Extensive variational computations are reported for the ground state energy of the non-relativistic ...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
Extensive variational computations are reported for the ground state energy of the non-relativistic ...
Calculations are performed on the \S <:Jd ground states of d ' + the H and HC) molecules using a b...
Extensive variational computations are reported for the ground state energy of the non-relativi...
Extensive variational computations are reported for the ground state energy of the non-relativi...
The variational-perturbation method is applied to the study of angular correlations between electron...
Author Institution: Department of Chemistry, Southern Illinois UniversityThe use of a single orbital...
In the first part of this work, a distribution function P(012) for the interelectronic angle in atom...
$^{*}$Supported by the United States Air Force OSR and National Science FoundationAuthor Institution...
In the first part of this work, a distribution function P(012) for the interelectronic angle in atom...
$^{*}$Supported by the United States Air Force OSR and National Science FoundationAuthor Institution...
$^{*}$This work assisted by a grant from the National Science Foundation with The University of Chic...
Extensive variational computations are reported for the ground state energy of the non-relativistic ...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...
The variational calculation of the energy of the Hydrogen Molecular (H2+) Cation\u27s LCAO-MO for t...