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Contribution List

Displaying 20 contributions out of 20
Session: Quantum Espresso Hack Session [1]: Overview of code and project, SVN, Parallelization
Session: Quantum Espresso Hack Session[10]: Implementation testing
Session: Quantum Espresso Hack Session[11]: Post-hack progress analysis
Session: Quantum Espresso Hack Session[12]: Discussion , Q&A, QE SVN update/merge, Manuscript
Session: Quantum Espresso Hack Session[13]: J coupling Theory and equations walkthrough
Session: Quantum Espresso Hack Session[14]: J coupling Theory and equations walkthrough
Session: Quantum Espresso Hack Session[15]: Ab initio J coupling
Session: Quantum Espresso Hack Session[16]: Implementation of Linear Response Terms
Session: Quantum Espresso Hack Session[17]:Implementation of LR Terms and Testing
Session: Quantum Espresso Hack Session[18]: Implementation of LR Terms and Testing
Session: Quantum Espresso Hack Session[19]: Post-hack progress analysis
Session: Quantum Espresso Hack Session[20]: Discussion , Q&A, QE SVN update/merge, Manuscript
Session: Quantum Espresso Hack Session[2]: NMR Theory in general, GIPAW Theory, Converse theory
Session: Quantum Espresso Hack Session[3]: Equations and implementation of GIPAW
Session: Quantum Espresso Hack Session[4]: Equations and implementation of GIPAW
Session: Quantum Espresso Hack Session[5]: Converse Approach, Recap of Theory, Redo input
Session: Quantum Espresso Hack Session[6]: Initialize parameters, Add the new terms to Hamiltonian
Session: Quantum Espresso Hack Session[7]: Calculate orbital magnetization
Session: Quantum Espresso Hack Session[8]: Calculate chemical shift
Session: Quantum Espresso Hack Session[9]: Implementation testing

Organizers

S. de Gironcoli (SISSA/DEMOCRITOS), P. Giannozzi (University of Udine), E. Kucukbenli (EPFL), L. Martin-Samos Colomer (University of Nova Gorica).
ICTP Local Organizer: I. Girotto