Schedule: Difference between revisions
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*10:40AM-11:30AM: Electronic structure via DFT methods: Example of graphene (Nikolić) | *10:40AM-11:30AM: Electronic structure via DFT methods: Example of graphene (Nikolić) | ||
*11:30AM-12:30PM: Lunch. | *11:30AM-12:30PM: Lunch. | ||
*12:30PM-1:20PM: DFT | *12:30PM-1:20PM: [https://wiki.physics.udel.edu/wiki_cmpb/images/0/06/Dft_applications.pdf Examples of DFT applications in physics and chemistry]. (Kang) | ||
*1:30PM-2:20PM: Hands-on: Basic Linux commands, editors, job scheduling, file transfer, desktop or laptop settings, etc. (Kang) | *1:30PM-2:20PM: Hands-on: Basic Linux commands, editors, job scheduling, file transfer, desktop or laptop settings, etc. (Kang) | ||
===Tuesday 08/20=== | ===Tuesday 08/20=== | ||
*9:00AM-9:30AM: Breakfast. | *9:00AM-9:30AM: Breakfast. | ||
*9:30AM-10:20AM: | *9:30AM-10:20AM: Introduction to DFT via VASP. (Kang) | ||
*10:40AM-11:30AM: | *10:40AM-11:30AM: Hands-on: H<sub>2</sub>O using VASP. (Kang) | ||
*11:00AM-12:30PM: Lunch. | *11:00AM-12:30PM: Lunch. | ||
*12:30PM-1:20PM:Introduction to DFT via OpenMX. (Kefayati). | *12:30PM-1:20PM:Introduction to DFT via OpenMX. (Kefayati). | ||
*1:30PM-2:20PM: Hands-on: H<sub>2</sub>O using VASP. ( | *1:30PM-2:20PM: Hands-on: H<sub>2</sub>O using VASP. (Kefayati) | ||
===Wednesday 08/21=== | ===Wednesday 08/21=== | ||
| Line 24: | Line 24: | ||
*12:30PM-1:20PM: DFT and Magnetism theory. (Kefayati) | *12:30PM-1:20PM: DFT and Magnetism theory. (Kefayati) | ||
*1:30PM-2:20PM: Hands-on: NiO using VASP (Kang) | *1:30PM-2:20PM: Hands-on: NiO using VASP (Kang) | ||
efayati | |||
===Thursday 08/22=== | ===Thursday 08/22=== | ||
*9:00AM-9:30AM: Breakfast. | *9:00AM-9:30AM: Breakfast. | ||
Revision as of 15:50, 16 August 2024
Bootcamp 2024
Monday 08/19
- 9:00AM-9:30AM: Breakfast.
- 9:30AM-10:20AM: Electronic structure via tight-binding methods: Example of graphene (Nikolić)
- 10:40AM-11:30AM: Electronic structure via DFT methods: Example of graphene (Nikolić)
- 11:30AM-12:30PM: Lunch.
- 12:30PM-1:20PM: Examples of DFT applications in physics and chemistry. (Kang)
- 1:30PM-2:20PM: Hands-on: Basic Linux commands, editors, job scheduling, file transfer, desktop or laptop settings, etc. (Kang)
Tuesday 08/20
- 9:00AM-9:30AM: Breakfast.
- 9:30AM-10:20AM: Introduction to DFT via VASP. (Kang)
- 10:40AM-11:30AM: Hands-on: H2O using VASP. (Kang)
- 11:00AM-12:30PM: Lunch.
- 12:30PM-1:20PM:Introduction to DFT via OpenMX. (Kefayati).
- 1:30PM-2:20PM: Hands-on: H2O using VASP. (Kefayati)
Wednesday 08/21
- 9:00AM-9:30AM: Breakfast.
- 9:00AM-9:50AM: Hands-on: Graphene using VASP. (Kang)
- 10:00AM-10:50AM: Introduce many-body perturbation theory (GW) combined with dynamical mean field theory (DMFT). (Kang)
- 11:00AM-12:30PM: Lunch.
- 12:30PM-1:20PM: DFT and Magnetism theory. (Kefayati)
- 1:30PM-2:20PM: Hands-on: NiO using VASP (Kang)
efayati
Thursday 08/22
- 9:00AM-9:30AM: Breakfast.
- 9:00AM-9:50AM: Ab initio many-body methods (LQSGW+DMFT, GW+EDMFT) applications in magnetism-related physics. (Kang)
- 10:00AM-10:50AM: Tutorial of LQSGW+DMFT. (Kang)
- 11:00AM-12:30PM: Lunch.
- 12:30PM-1:20PM: Hands-on: Fe using OpenMX: ground state calculation. (Kefayati)
- 1:30PM-2:20PM: Hands-on: Fe using OpenMX: Heisenberg exchange parameters calculation + Adiabatic magnon dispersion of Fe using spin wave theory. (Kefayati)
Friday 08/23
- 9:00AM-9:30AM: Breakfast.
- 9:00AM-9:50AM:
- 10:00AM-10:50AM:
- 11:00AM-12:30PM: Lunch.
- 12:30PM-1:20PM:
- 1:30PM-2:20PM:
