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14:20, 24 February 2020 Kaltakm talk contribs created page MP2 (Created page with "By specifying {{TAG|ALGO}}=''MP2'' in the {{TAG|INCAR}} file VASP calculates MP2 correlation energies. It is strongly recommended to calculate all virtual states spanned by th...")
14:15, 24 February 2020 Kaltakm talk contribs created page LMP2LT (Created page with "{{TAGDEF|LMP2LT|.FALSE. {{!}} .TRUE.}} {{DEF|LMP2LT|.FALSE.|}} Description: {{TAG|LMP2LT}} selects a Laplace transformed MP2 algorithm. ---- If {{TAG|LMP2LT}}=.TRUE. and {{T...")
13:33, 16 December 2019 Kaltakm talk contribs created page LFOCKACE (Created page with "{{TAGDEF|LFOCKACE|.TRUE. {{!}} .FALSE. | .TRUE.}} Description: {{TAG|LHFCALC}} determines whether the Adaptively Compressed Exchange Operator is used.{{cite|linlin:jctc:2016}...")
16:09, 29 July 2019 Kaltakm talk contribs deleted page Technical aspects of RPA-ACFDT calculations (content was: "To reach technical convergence, a number of flags are available to control the evaluation of the ACFDT-RPA correlation energy in the fourth step. The expression f..." (and the only contributor was "Kaltakm"))
13:31, 29 July 2019 Kaltakm talk contribs uploaded File:Chi.png (The independent particle polarizability can be written as product of two non-interacting Green's function propagating in opposite directions.)
11:40, 29 July 2019 Kaltakm talk contribs uploaded File:DMP2.png (direct MP2 diagram)
15:51, 25 July 2019 Kaltakm talk contribs deleted page RPA/ACFDT: Correlation energy in the Random Phase Approximation (content was: "__TOC__ == Diagrammatic approach to the correlation energy == == References == <references/> Category:Theory Category:VASP6Category:Low-scaling GW an..." (and the only contributor was "Kaltakm"))
15:50, 25 July 2019 Kaltakm talk contribs moved page Groundstate in the Random Phase Approximation to RPA/ACFDT: Correlation energy in the Random Phase Approximation
10:54, 25 July 2019 Kaltakm talk contribs deleted page Low scaling ACFDT/RPA and GW algorithms (content was: "__TOC__ Available as of VASP.6 are low scaling algorithms for ACFDT/RPA<ref name="kaltak2"/> and GW calculations.<ref name="liu"/> A theoretical description of the ACFDT/RPA total energies is found ACFDT/RPA calculations#ACFDTR/RPAR|...")
17:09, 24 July 2019 Kaltakm talk contribs moved page Talk:GW calculations to Talk:Practical guide to GW calculations
17:09, 24 July 2019 Kaltakm talk contribs moved page GW calculations to Practical guide to GW calculations
16:56, 24 July 2019 Kaltakm talk contribs moved page The GW approximation of Hedin's equations to GW approximation of Hedin's equations
16:19, 23 July 2019 Kaltakm talk contribs deleted page Random Phase Approximation (content was: "__TOC__ == References == <references> </references> ---- Category:Many-Body Perturbation Theory Category:ACFDT Category:Theory Category:VASP" (and the only contributor was "Kaltakm"))
16:07, 24 June 2019 Kaltakm talk contribs uploaded File:SrVO3 structure.png (SrVO3 structure (perfect cubic))
15:51, 24 June 2019 Kaltakm talk contribs uploaded File:DOS SrVO3 comparison.png (Comparison of density of states of SrVO3 for PBE, HSE and GW0.)
18:45, 2 July 2018 Kaltakm talk contribs deleted page CRPA of SrVO3 (content was: "== DFT, GW and HSE Calculation == === DFT groundstate calculation === The first step is a conventional DFT (in this case PBE) groundstate calculation. *{{TAG|I..." (and the only contributor was "Kaltakm"))
15:07, 3 October 2017 Kaltakm talk contribs deleted page GW recipes (content was: "__TOC__ == First step: DFT calculation == ''GW'' calculations always require the calculation of a standard DFT {{FILE|WAVECAR}} file in an initial step, using for instance the following INCAR file: {{TAGBL|System}} = Si {{TAGBL|NBANDS...")
14:18, 21 September 2017 Kaltakm talk contribs deleted page Low scaling ACFDT/RPA and GW calculations (Author request: content was: "__TOC__ Available as of VASP.6 are low scaling algorithms for ACFDT/RPA<ref name="kaltak2"/> and GW calculations#GWR|GW..." (and the only contributor was "[[Special:Contributions/Kal...)
10:37, 21 September 2017 Kaltakm talk contribs deleted page GWR and ACFDTR calculations calculations (Author request: content was: "__TOC__ The ACFDTR/RPAR and GWR routines are implemented to support GW and RPA calculations for large scale systems and are available only in vasp.6. In contras..." (and the only contributor was "[[Special:Contributions/...)