Add to ORKGComputational Theoretical Chemnistry is a research area which, as far as electronic structure problems are concerned, encompasses essentially the development of theoretically sound, yet computionally feasable quantum mechanical models for atoms melecules and the solid state. ... Zie: Introduction
This chapter is a review of some methods used for the computation of relativistic atomic and molecul...
Just as Newtonian law governs classical physics, the Schrödinger equation (SE) and the relativistic ...
In this chapter we focus first on the theoretical methods and relevant computational approaches to c...
Computational Theoretical Chemnistry is a research area which, as far as electronic structure proble...
The basic ideas of relativistic quantum chemistry are highlighted, with the most important ingredien...
This book presents a unified approach to modern relativistic theory of the electronic structure of a...
In this thesis we describe a method for relativistic quantum mechanical calculations on molecules. W...
Accurate quantum computational chemistry has evolved dramatically. The size of molecular systems, wh...
Theoretical and computational chemistry, in particular: electron correlation structure methods; auto...
CRM Proceedings & Lecture Notes, vol 41This paper is a short review of computational issues arising ...
Today's scientific progress would be unthinkable without theoretical and computational assistance. T...
Einstein proposed his theory of special relativity in 1905. For a long time it was believed that thi...
A brief summary of the author’s research projects for deepening and extending the quantum principles...
An introduction to the principles of quantum mechanics needed in physical chemistry. Mathematical to...
In this chapter we focus first on the theoretical methods and relevant computational approaches to c...
This chapter is a review of some methods used for the computation of relativistic atomic and molecul...
Just as Newtonian law governs classical physics, the Schrödinger equation (SE) and the relativistic ...
In this chapter we focus first on the theoretical methods and relevant computational approaches to c...
Computational Theoretical Chemnistry is a research area which, as far as electronic structure proble...
The basic ideas of relativistic quantum chemistry are highlighted, with the most important ingredien...
This book presents a unified approach to modern relativistic theory of the electronic structure of a...
In this thesis we describe a method for relativistic quantum mechanical calculations on molecules. W...
Accurate quantum computational chemistry has evolved dramatically. The size of molecular systems, wh...
Theoretical and computational chemistry, in particular: electron correlation structure methods; auto...
CRM Proceedings & Lecture Notes, vol 41This paper is a short review of computational issues arising ...
Today's scientific progress would be unthinkable without theoretical and computational assistance. T...
Einstein proposed his theory of special relativity in 1905. For a long time it was believed that thi...
A brief summary of the author’s research projects for deepening and extending the quantum principles...
An introduction to the principles of quantum mechanics needed in physical chemistry. Mathematical to...
In this chapter we focus first on the theoretical methods and relevant computational approaches to c...
This chapter is a review of some methods used for the computation of relativistic atomic and molecul...
Just as Newtonian law governs classical physics, the Schrödinger equation (SE) and the relativistic ...
In this chapter we focus first on the theoretical methods and relevant computational approaches to c...