The Psi-k Community

Please read this announcement about the new Psi-k mailing list. MISSION: Psi-k is a Europe-based, worldwide network of researchers working on the advancement of first-principles computational materials science. Its mission is to develop fundamental theory, algorithms, and computer codes in order to understand, predict, and design materials properties and functions. Theoretical condensed matter physics, quantum … Continue reading The Psi-k Community

Psi-k workshops 2013

Workshop on the use of the CRYSTAL code on parallel computers for ground and excited state calculations, 31 January – 01 February, London, UK Calculation of optical properties of nanostructures from first principles, 18-22 February, Lausanne, Switzerland (). 6th International ABINIT developer workshop, 15-19 April, Dinard, France (). Materials chemomechanics at the atomic scale: modelling … Continue reading Psi-k workshops 2013

What is Psi-k?

The mission of the Psi-k organisation MISSION: Psi-k is a Europe-based, worldwide network of researchers working on the advancement of first-principles computational materials science. Its mission is to develop fundamental theory, algorithms, and computer codes in order to understand, predict, and design materials properties and functions. Theoretical condensed matter physics, quantum chemistry, thermodynamics, and statistical … Continue reading What is Psi-k?

Working Groups

Psi-k Working Groups Note: Working Group leader(s) are included in bold. The name in capitals at the head of each main theme is the overseeing trustee. A.   PHYSICAL FORMALISMS: GROUND STATE AND SPECTROSCOPY OF MANY-ELECTRON SYSTEMS SILKE BIERMANN (ÉCOLE POLYTECHNIQUE, PARIS), PATRICK RINKE (TECHNICAL UNIVERSITY MUNICH) 1. Density and density-matrix functional theories including improved functionals and … Continue reading Working Groups