DFT U method with WIEN2k

0:06:35

WT17: How to do SCF calculation using DFT+U method with WIEN2k | Hubbard model

0:07:33

WIEN2k (LDA+U, AMF, 1shot, spin)

0:08:11

RSPt tutorial 5: DFT+U (Recap of the theory)

0:12:29

WT19: How to do SCF calculation using full hybrid functional (unscreened and screened) with WIEN2k

0:06:32

WIEN2k (NiS2, LDA+U, AMF)

0:08:14

WIEN2k (LDA+U, AMF, spin)

0:09:00

WT20: How to calculate DOS (density of states) and PDOS with WIEN2k | Save plots as EPS and PNG

0:04:06

WIEN2k (NiS2, LDA+U (AMF), optic (Kramars-Kronig))

0:08:16

WIEN2k (Exercise1, outline)

0:14:09

PWscf (LDA+U calculation)

0:03:13

WIEN2k (surface structure, optimization (RORT method))

0:09:59

Electronic Density with wien2k ( TiC example )

0:00:55

Introduction #DFT #Wien2k #QuantumESPRESSO

0:03:56

WIEN2k (monolayer graphene)

0:03:49

How to use EV-GGA XC in WIEN2K

0:09:16

WT18: How to do SCF calculation using onsite exact-exchange and hybrid functionals with WIEN2k

0:13:32

WIEN2k (Exercise3, outline)

0:13:00

WT03: Volume Optimization with constant a:b:c ratio in WIEN2k

0:12:27

WIEN2k (boltztrap, LDA+U, AMF, spin)

0:13:24

WT02: Initialization and SCF calculation using PBE-GGA exchange correlation potential in WIEN2k

0:04:01

structure de bande avec Wien2k

1:08:40

QE tutorial 2022 - Hands-on: DFT+U and DFT+U+V: How does it work? - Iurii Timrov & Matteo Cococcioni

1:09:40

WIEN2k workshop: DFT and the APW+lo method

0:14:06

WT05: How to calculate optical properties with WIEN2k | Save data and plots in EPS and PNG format