The problem arising due to the use of finite basis set expansion method for the solution of the Dirac equation in the Relativistic Mean Field theory, is analyzed, particularly the appearance of the ''Spurious'' states. A satisfactory prescription (or remedy) for the avoidance of these ''Spurious'' states is proposed. Illustrative results for this are presented. The proposed prescription is critically analyzed and it is shown to be consistent with that encountered for the spherical case in the molecular and atomic physics problems
An algorithm is given for constructing accurate solutions to the radial Dirac equation in a B-polyno...
AbstractIt is demonstrated that the use of a Gaussian charge distribution to represent the nucleus i...
In the present work we study numerical solution of the radial Dirac equation in a specific case - ab...
A new approach to finite basis sets for the Dirac equation is developed. It solves the problem of sp...
This chapter is a review of some methods used for the computation of relativistic atomic and molecul...
A comparison is made of the accuracy achieved in finite difference and finite basis set approximatio...
SIGLEAvailable from British Library Document Supply Centre- DSC:D81599 / BLDSC - British Library Doc...
Taking into account relativistic effects in quantum chemistry is crucial for accurate computations i...
Variational solutions to the Dirac equation in a discrete L2 basis set are investigated. Numerical c...
In this paper we consider the problem of the occurrence of spurious modes when computing the eigenva...
In this thesis we investigate solution of Dirac equation in spherically symmetric po- tential. The p...
Efforts have been made. to solve the Dirac equation with axially deformed scalar and vector Woods-Sa...
To solve the Dirac equation with the finite difference method, one has to face up to the spurious-st...
A variational discrete representation of the relativistic energy spectrum of an electron in a Coulom...
It is shown that it is possible to construct, within the framework of a basis set expansion method, ...
An algorithm is given for constructing accurate solutions to the radial Dirac equation in a B-polyno...
AbstractIt is demonstrated that the use of a Gaussian charge distribution to represent the nucleus i...
In the present work we study numerical solution of the radial Dirac equation in a specific case - ab...
A new approach to finite basis sets for the Dirac equation is developed. It solves the problem of sp...
This chapter is a review of some methods used for the computation of relativistic atomic and molecul...
A comparison is made of the accuracy achieved in finite difference and finite basis set approximatio...
SIGLEAvailable from British Library Document Supply Centre- DSC:D81599 / BLDSC - British Library Doc...
Taking into account relativistic effects in quantum chemistry is crucial for accurate computations i...
Variational solutions to the Dirac equation in a discrete L2 basis set are investigated. Numerical c...
In this paper we consider the problem of the occurrence of spurious modes when computing the eigenva...
In this thesis we investigate solution of Dirac equation in spherically symmetric po- tential. The p...
Efforts have been made. to solve the Dirac equation with axially deformed scalar and vector Woods-Sa...
To solve the Dirac equation with the finite difference method, one has to face up to the spurious-st...
A variational discrete representation of the relativistic energy spectrum of an electron in a Coulom...
It is shown that it is possible to construct, within the framework of a basis set expansion method, ...
An algorithm is given for constructing accurate solutions to the radial Dirac equation in a B-polyno...
AbstractIt is demonstrated that the use of a Gaussian charge distribution to represent the nucleus i...
In the present work we study numerical solution of the radial Dirac equation in a specific case - ab...