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Session: Functionals and efficient approaches

Place

Location: ICTP
Address: Strada Costiera, 11 I - 34151 Trieste (Italy)
Room: Budinich Lecture Hall (LB)
Date: 14 Jan 09:00 - 11:35

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09:00
10:00
11:00
Introduction to the session
Leonardo Building - Budinich Lecture Hall, ICTP
Advances in semi-empirical density functionals for molecules and materials
Leonardo Building - Budinich Lecture Hall, ICTP
Electron correlation from the adiabatic-connection-fluctuation-dissipation-theorem approach for a multireference wavefunction
Leonardo Building - Budinich Lecture Hall, ICTP
Strongly Constrained and Appropriately Normed (SCAN) Semilocal Density Functional: Accurate and Efficient for Structures and Energies of Diversely-Bonded Materials
Large Scale Many-Body Perturbation Theory Calculations: Methodological Developments, Data Collections, Validation and Applications
Leonardo Building - Budinich Lecture Hall, ICTP
Concluding Remarks
Leonardo Building - Budinich Lecture Hall, ICTP

Organizers

Shobhana Narasimhan (Jawaharlal Nehru Centre for Advanced Scientific Research Jakkur, Bangalore, India), Lucia Reining (Laboratoire des Solides Irradiés, Ecole Polytechnique, Palaiseau, France), Local Organiser: Maria Peressi (University of Trieste, Department of Physics, Trieste, Italy)

Co-sponsors