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10:53, 23 November 2021 Tobias talk contribs created page Construction:Intrinsic Atomic Orbitals (first draft)
16:36, 22 November 2021 Kaltakm talk contribs created page LRPAFORCE (Created page with "{{TAGDEF|LRPAFORCE|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LRPAFORCE}}=.TRUE. calculates forces in the RPA. ---- Available as of VASP.6.1. This tag is optionally u...")
15:23, 22 November 2021 Tobias talk contribs created page Construction:Unitary Matrix Constrained Optimization (init entry)
11:14, 22 November 2021 Kaltakm talk contribs created page NELMGW (Created page with "{{TAGDEF|NELMGW|[integer]|1}} Description: Controls the number of self-consistent GW steps. ---- This tag is effective for {{TAG|ALGO}}=EVGW[0] | QPGW[0] | GW[0][R][K] | an...")
10:03, 2 November 2021 Karsai talk contribs deleted page Machine learning force field calculations: Important algorithms (content was: "This page describes important algorithms used in the machine learning force field method. == Sampling of training data and local reference configurations == We employ a learning scheme where structures are only added to the list of training structures when local reference configurations are picked for atoms that have an error in the force higher than a given threshold. So in t...", and the only contributor was "Karsai" (talk))
13:23, 29 October 2021 User account Tal talk contribs was created by Vaspmaster talk contribs
13:16, 21 October 2021 Karsai talk contribs moved page MAchine learning force field calculations: Important algorithms to Machine learning force field calculations: Important algorithms
13:14, 21 October 2021 Karsai talk contribs created page MAchine learning force field calculations: Important algorithms (Created page with "This page describes important algorithms used in the machine learning force field method. == Sampling of training data and local reference configurations == Usually one can...")
08:56, 19 October 2021 Ces talk contribs created page File:Logo.png (The new VASP logo)
08:56, 19 October 2021 Ces talk contribs uploaded File:Logo.png (The new VASP logo)
08:10, 13 October 2021 Singraber talk contribs moved page ML XMIX to ML CX (Tag was renamed)
16:04, 12 October 2021 Karsai talk contribs created page ML IALGO LINREG (Created page with "{{TAGDEF|ML_IALGO_LINREG|[integer]|1}} Description: This tag determines how to solve the linear equations in the ridge regression for machine learning. ---- The following op...")
07:38, 12 October 2021 Singraber talk contribs moved page Template:BOX to Template:NB
18:57, 10 October 2021 Singraber talk contribs created page Template:)) (Created page with "}}")
18:56, 10 October 2021 Singraber talk contribs created page Template:(( (Created page with "{{")
08:43, 8 October 2021 Singraber talk contribs created page Template:C (Created page with "{{#switch: {{{1}}} | vcyan = {{{2}}} | vgrey = {{{2}}} | vblue = ...")
20:09, 7 October 2021 Singraber talk contribs created page Template:BOX (Created page with "")
14:20, 6 September 2021 User account Ftran talk contribs was created by Vaspmaster talk contribs
07:24, 1 September 2021 Karsai talk contribs created page File:MLFF Liquid Si tutorial.tgz
07:24, 1 September 2021 Karsai talk contribs uploaded File:MLFF Liquid Si tutorial.tgz
07:22, 1 September 2021 Karsai talk contribs deleted page File:MLFF Liquid Si.tgz
06:52, 23 August 2021 Karsai talk contribs moved page ML FF XMIX to ML XMIX
06:52, 23 August 2021 Karsai talk contribs moved page ML FF WTSIF to ML WTSIF
06:52, 23 August 2021 Karsai talk contribs moved page ML FF WTOTEN to ML WTOTEN
06:51, 23 August 2021 Karsai talk contribs moved page ML FF WTIFOR to ML WTIFOR
06:51, 23 August 2021 Karsai talk contribs moved page ML FF W1 MB to ML W1
06:51, 23 August 2021 Karsai talk contribs moved page ML FF SION2 MB to ML SION2
06:51, 23 August 2021 Karsai talk contribs moved page ML FF SION1 MB to ML SION1
06:50, 23 August 2021 Karsai talk contribs moved page ML FF SIGW0 MB to ML SIGW0
06:50, 23 August 2021 Karsai talk contribs moved page ML FF SIGV0 MB to ML SIGV0
06:49, 23 August 2021 Karsai talk contribs moved page ML FF RDES SPARSDES MB to ML RDES SPARSDES
06:49, 23 August 2021 Karsai talk contribs moved page ML FF RCUT2 MB to ML RCUT2
06:49, 23 August 2021 Karsai talk contribs moved page ML FF RCUT1 MB to ML RCUT1
06:48, 23 August 2021 Karsai talk contribs moved page ML FF RCOUPLE MB to ML RCOUPLE
06:48, 23 August 2021 Karsai talk contribs moved page ML FF NRANK SPARSDES MB to ML NRANK SPARSDES
06:48, 23 August 2021 Karsai talk contribs moved page ML FF NMDINT to ML NMDINT
06:47, 23 August 2021 Karsai talk contribs moved page ML FF NHYP1 MB to ML NHYP
06:47, 23 August 2021 Karsai talk contribs moved page ML FF NATOM COUPLED MB to ML NATOM COUPLED
06:46, 23 August 2021 Karsai talk contribs moved page ML FF MRB2 MB to ML MRB2
06:46, 23 August 2021 Karsai talk contribs moved page ML FF MRB1 MB to ML MRB1
06:45, 23 August 2021 Karsai talk contribs moved page ML FF MHIS to ML MHIS
06:45, 23 August 2021 Karsai talk contribs moved page ML FF MCONF NEW to ML MCONF NEW
06:45, 23 August 2021 Karsai talk contribs moved page ML FF MCONF to ML MCONF
06:44, 23 August 2021 Karsai talk contribs moved page ML FF MB MB to ML MB
06:44, 23 August 2021 Karsai talk contribs moved page ML FF LSPARSDES MB to ML LSPARSDES
06:44, 23 August 2021 Karsai talk contribs moved page ML FF LMLFF to ML LMLFF
06:43, 23 August 2021 Karsai talk contribs moved page ML FF LMAX2 MB to ML LMAX2
06:43, 23 August 2021 Karsai talk contribs moved page ML FF LHEAT MB to ML LHEAT
06:43, 23 August 2021 Karsai talk contribs moved page ML FF LEATOM MB to ML LEATOM
06:42, 23 August 2021 Karsai talk contribs moved page ML FF LCRITERIA to ML ICRITERIA