Visualitzant Recerca per matèria "Quantum chemistry -- Congresses"

Visualitzant Recerca per matèria "Quantum chemistry -- Congresses"

Ara es mostren els resultats 37-51 de 51

A Fractional view of the exchange-correlation functional in density-functional theory

2010-07-07 Classe

Mori-Sánchez, Paula

New advances in NOF theory: paving the way towards chemical accuracy

2010-07-07 Classe

Piris, Mario

Anharmonicity as a possible explenation of the Eigen-Zundel dilema in the IR spectrum of H+(H2O)21

2010-07-08 Classe

Torrent Sucarrat, Miquel

Describing dissociation in variational second order density matrix theory

2010-07-08 Classe

Van Aggelen, Helen

On variational principles in density and density matrix functional theories

2010-07-08 Classe

Levy, Mel

Spin component scaling in multiconfiguration perturbation theory

2010-07-08 Classe

Szabados, Agnes

Numerical integration along the adiabatic connection

2010-07-08 Classe

Savin, Andreas

Posmom: the unobserved observable

2010-07-08 Classe

Gill, Peter

Spin-coupled descriptions of organic reactivity

2010-07-08 Classe

Cooper, David

Unexpected features of relativistic models

2010-07-08 Classe

Karwowski, Jacek

What ab-initio Quantum Chemistry (AIQC) and Density Functional Theory (DFT) can learn from each other

2010-07-08 Classe

Kutzelnigg, Werner

Aromaticity and the electron localization function, ELF

2010-07-08 Classe

Fuentealba, Patricio

Derivative discontinuity, band gap and LUMO orbital in density functional theory

2010-07-08 Classe

Yang, Weitao

Explicitly correlated F12 methods using CUSP conditions

2010-07-08 Classe

Ten-no, Seiichiro

Closing

2010-07-08 Classe

Solà i Puig, Miquel

Ara es mostren els resultats 37-51 de 51