RASESMA 2023 Nairobi: Difference between revisions
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* Virtual machine via [[ICTP cloud|ICTP cloud]] ('''strongly suggested mode''', works through internet connection inside a browser) | * Virtual machine via [[ICTP cloud|ICTP cloud]] ('''strongly suggested mode''', works through internet connection inside a browser) | ||
* Install the [[Yambo_Virtual_Machine|yambo virtual machine]] on your laptop / desktop (requires Oracle virtual box. Pre-download of the Virtual machine. No internet connection needed) | * Install the [[Yambo_Virtual_Machine|yambo virtual machine]] on your laptop / desktop (requires Oracle virtual box. Pre-download of the Virtual machine. No internet connection needed) | ||
<!-- | |||
URL of the machine : https://ins45100.ictp.it/ | |||
READ-ONLY PASSWORD for TUTOR (ictptutor) access: | |||
NairibiTutor | |||
READ-WRITE password for PARTICIPANT's (ictpuser) access: | |||
NairobiUser | |||
--> | |||
=== User installation === | === User installation === | ||
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* Download the tutorial files following the [[Tutorials|instructions here]] | * Download the tutorial files following the [[Tutorials|instructions here]] | ||
* Here the instruction to install [[Yambopy via conda|Yambopy via conda]] | * Here the instruction to install [[Yambopy via conda|Yambopy via conda]] | ||
== Sunday 19 Feb == | |||
For who will be already in Nairobi we will have a '''get together & Yambo installation''' session at the YMCA Central starting. Time will be decided on the basis of who will participate. | |||
If you are interested drop an E-mail at rasesma2023@tukenya.ac.ke | |||
== Monday 20 Feb == | == Monday 20 Feb == | ||
{| class="wikitable" | {| class="wikitable" | ||
|+Morning | |+Morning | ||
Revision as of 15:20, 3 February 2023
Setting up Yambo, QE and the tutorials
To be able to follow the school you need (i) a running version of the yambo code, and (ii) the files and databases needed to run the tutorials.
You have several options to prepare all needed to run the tutorials.
Virtual Machine(s)
The easiest way is to access to a virtual machine which contains both (i) yambo and (ii) the tutorials.
You can do it in two alternative ways:
- Virtual machine via ICTP cloud (strongly suggested mode, works through internet connection inside a browser)
- Install the yambo virtual machine on your laptop / desktop (requires Oracle virtual box. Pre-download of the Virtual machine. No internet connection needed)
User installation
You can also setup the yambo code on your on laptop / desktop using different methods.
As far as the Yambo source is concerned you can:
- Install Yambo via Docker
- Download and install yambo on your laptop / desktop (requires a linux machine).
- Install yambo on your laptop/desktop/cluster via Spack.
Tutorials, instead, can be installed in two ways:
- Download the tutorial files following the instructions here
- Here the instruction to install Yambopy via conda
Sunday 19 Feb
For who will be already in Nairobi we will have a get together & Yambo installation session at the YMCA Central starting. Time will be decided on the basis of who will participate.
If you are interested drop an E-mail at rasesma2023@tukenya.ac.ke
Monday 20 Feb
| Time | Lecture | Speaker |
|---|---|---|
| 09:00 - 09:20 | Welcome & Introduction | The Organizers |
| 09:30 - 10:20 | General Introduction to Density Functional Theory | TBC |
| 10:20 - 11:10 | Kohn-Sham, Exchange-Correlation functionals, approximations | TBC |
| 11:10 - 11:30 | Break | |
| 11:30 - 12:20 | DFT in practice: Plane-Waves, pseudopotentials | TBC |
| 12:20 - 13:30 | Lunch |
| Time | Tutorial | Tutor(s) |
|---|---|---|
| 13:30 - 15:00 | Introduction to Quantum-Espresso | Mike Atambo |
| 15:00 - 15:30 | Break | |
| 15:30 - 17:00 | Introduction to Yambo | Yambo Team |
| Technical Introduction to Yambo | ||
| The Yambo Philosophy | ||
| database generation for bulk hBN |
Tuesday 21 Feb
| Time | Lecture | Speaker |
|---|---|---|
| 09:00 - 09:50 | Introduction to Spectroscopy | Matteo Gatti |
| 09:50 - 10:40 | Linear Response Theory | Andrea Marini |
| 10:40 - 11:10 | Break | |
| 11:10 - 12:00 | TBC | TBC |
| 12:00 - 13:00 | Lunch |
| Time | Tutorial | Tutor(s) |
|---|---|---|
| 13:00 - 17:00 | Initialization | Yambo Team |
| Input file generation and command line options (5.0) | ||
| Break | ||
| Optics at the independent particle level | ||
| Local fields |
Wednesday 22 Feb
| Time | Lecture | Speaker |
|---|---|---|
| 09:00 - 09:50 | Quantum Mechanics in a nutshell | Andrea Marini |
| 09:50 - 10:40 | Correlation & Diagrams | Andrea Marini |
| 10:40 - 11:10 | Break | |
| 11:10 - 12:00 | TBC | TBC |
| 12:00 - 13:00 | Lunch |
| Time | Tutorial | Tutor(s) |
|---|---|---|
| 13:00 - 17:00 | How to obtain the quasi-particle band structure of a bulk material: h-BN | Yambo Team |
| Break | ||
| GW parallel strategies |