method of spin-density functional
1Density functional theory — Electronic structure methods Tight binding Nearly free electron model Hartree–Fock method Modern valence bond Generalized valence bond Møller–Plesset perturbation theory …
2Amsterdam Density Functional — (ADF) is a program for first principles electronic structure calculations that makes use of density functional theory. [ Computational Chemistry , David Young, Wiley Interscience, 2001. Appendix A. A.2.1 pg 332, ADF ] ADF was first developed in… …
3Local-density approximation — The local density approximation (LDA) is an approximation of the exchange correlation (XC) energy functional in density functional theory (DFT) by taking the XC energy of an electron in a homogeneous electron gas of a density equal to the density …
4Classical-map hypernetted-chain method — For the Canadian radio station, see CHNC FM . The classical map hypernetted chain method (CHNC method) is a method used in many body theoretical physics for interacting uniform electron liquids in two and three dimensions, and for interacting… …
5Molecular dynamics — (MD) is a computer simulation of physical movements of atoms and molecules. The atoms and molecules are allowed to interact for a period of time, giving a view of the motion of the atoms. In the most common version, the trajectories of molecules… …
6Magnetic resonance imaging — MRI redirects here. For other meanings of MRI or Mri, see MRI (disambiguation). Magnetic resonance imaging Intervention Sagittal MR image of the knee ICD 10 PCS B?3?ZZZ …
7Theorie de la fonctionnelle de la densite — Théorie de la fonctionnelle de la densité Méthodes numériques pour le calcul de la structure électronique Hartree Fock Théorie de la perturbation de Møller Plesset Interaction de configuration Méthode du cluster couplé Champ multi… …
8Théorie de la fonctionnelle de la densité — Pour les articles homonymes, voir DFT. La théorie de la fonctionnelle de la densité (pour Density Functional Theory, sous entendu électronique : DFT) constitue au début du XXIe siècle l une des méthodes les plus utilisées dans les… …
9Théorie de la fonctionnelle densité — Théorie de la fonctionnelle de la densité Méthodes numériques pour le calcul de la structure électronique Hartree Fock Théorie de la perturbation de Møller Plesset Interaction de configuration Méthode du cluster couplé Champ multi… …
10Nobel Prizes — ▪ 2009 Introduction Prize for Peace The 2008 Nobel Prize for Peace was awarded to Martti Ahtisaari, former president (1994–2000) of Finland, for his work over more than 30 years in settling international disputes, many involving ethnic,… …
