User contributions for Wolloch
11 March 2025
- 13:2913:29, 11 March 2025 diff hist −32 Setting up an electronic minimization →Recommendations and advice current
- 13:1813:18, 11 March 2025 diff hist 0 Terminal output No edit summary current
10 March 2025
- 11:2811:28, 10 March 2025 diff hist +4 Setting up an electronic minimization →Recommendations and advice
4 March 2025
- 15:1015:10, 4 March 2025 diff hist −7 Terminal output →ScaLAPACK
- 15:0815:08, 4 March 2025 diff hist −27 Terminal output →ScaLAPACK
3 March 2025
- 14:1214:12, 3 March 2025 diff hist 0 Setting up an electronic minimization →Running the calculation
- 14:1014:10, 3 March 2025 diff hist +33 Setting up an electronic minimization →Running the calculation
- 14:1014:10, 3 March 2025 diff hist +28 Setting up an electronic minimization →Running the calculation
- 14:0514:05, 3 March 2025 diff hist −2 Setting up an electronic minimization →Creating the INCAR file
- 11:2711:27, 3 March 2025 diff hist +91 Terminal output No edit summary
- 11:2511:25, 3 March 2025 diff hist +363 Setting up an electronic minimization No edit summary
- 11:2211:22, 3 March 2025 diff hist −19 Setting up an electronic minimization →Related tags and articles
- 11:1811:18, 3 March 2025 diff hist +3 Terminal output →Error and warning messages
- 11:1711:17, 3 March 2025 diff hist +5 Terminal output →The body
- 11:1211:12, 3 March 2025 diff hist −2 Terminal output →No of nodes, MPI ranks, OpenMP threads, and parallelization
- 11:1211:12, 3 March 2025 diff hist +40 Terminal output →No of nodes, MPI ranks, OpenMP threads, and parallelization
- 11:0611:06, 3 March 2025 diff hist +163 Setting up an electronic minimization →Running the calculation
- 10:5910:59, 3 March 2025 diff hist +1 Setting up an electronic minimization →Creating the INCAR file
- 10:5710:57, 3 March 2025 diff hist −288 Setting up an electronic minimization →Creating the KPOINTS file
- 10:5410:54, 3 March 2025 diff hist +6 Setting up an electronic minimization →Step-by-step instructions
- 10:5410:54, 3 March 2025 diff hist −82 Setting up an electronic minimization →Setting up the POSCAR file
- 10:4410:44, 3 March 2025 diff hist −252 Setting up an electronic minimization →Step-by-step instructions
- 10:4110:41, 3 March 2025 diff hist +74 Setting up an electronic minimization No edit summary
- 10:3910:39, 3 March 2025 diff hist +134 Setting up an electronic minimization →Recommendations and advice
- 10:3710:37, 3 March 2025 diff hist −252 Setting up an electronic minimization →Step-by-step instructions
- 10:3410:34, 3 March 2025 diff hist +504 Setting up an electronic minimization →Recommendations and advice
- 09:5609:56, 3 March 2025 diff hist +342 Setting up an electronic minimization →Recommendations and advice
- 09:3409:34, 3 March 2025 diff hist +51 Setting up an electronic minimization →Running the calculation
- 09:3009:30, 3 March 2025 diff hist +6 Terminal output No edit summary
- 09:3009:30, 3 March 2025 diff hist +40 N Construction:Stdout Wolloch moved page Construction:Stdout to Construction:Screen output: stderr will also be printed on the screen current Tag: New redirect
- 09:3009:30, 3 March 2025 diff hist 0 m Terminal output Wolloch moved page Construction:Stdout to Construction:Screen output: stderr will also be printed on the screen
- 09:2809:28, 3 March 2025 diff hist +353 Terminal output →The header
28 February 2025
- 16:4216:42, 28 February 2025 diff hist +47 Setting up an electronic minimization →Running the calculation
- 16:4116:41, 28 February 2025 diff hist +31 Terminal output →Error and warning messages
- 16:3816:38, 28 February 2025 diff hist +5,782 Terminal output No edit summary
- 16:1216:12, 28 February 2025 diff hist +1,502 Terminal output No edit summary
- 15:2615:26, 28 February 2025 diff hist +100 Setting up an electronic minimization →Setting up the POSCAR file
- 15:1615:16, 28 February 2025 diff hist +76 N File:GaAs zincblende py4vasp 2SC.png 2x2x2 Supercell of bulk zincblende GaAs. Created with py4vasp. current
- 14:1214:12, 28 February 2025 diff hist +255 Setting up an electronic minimization →Setting up the POSCAR file
- 13:4913:49, 28 February 2025 diff hist +39 Setting up an electronic minimization No edit summary
- 13:4913:49, 28 February 2025 diff hist +1,192 N Terminal output Created page with "The standard output of VASP has several sections. Some examples for each are given below: === No of nodes, MPI ranks, OpenMP threads, and parallelization === The first output details rank, threading, and parallelization information. E.g with OpenMP threading: running 16 mpi-ranks, with 4 threads/rank, on 1 nodes distrk: each k-point on 4 cores, 4 groups distr: one band on 1 cores, 4 groups or without OpenMP thread..."
- 10:5110:51, 28 February 2025 diff hist +192 Setting up an electronic minimization No edit summary
- 10:2410:24, 28 February 2025 diff hist −53 Setting up an electronic minimization →Step-by-step instructions
- 08:5308:53, 28 February 2025 diff hist −84 OSZICAR No edit summary
27 February 2025
- 16:3816:38, 27 February 2025 diff hist +3,048 Setting up an electronic minimization No edit summary
- 16:1916:19, 27 February 2025 diff hist +186 Setting up an electronic minimization →Example
- 16:1016:10, 27 February 2025 diff hist +158 Setting up an electronic minimization →Creating the KPOINTS file
- 16:0716:07, 27 February 2025 diff hist +27 Setting up an electronic minimization →Step-by-step instructions
- 16:0616:06, 27 February 2025 diff hist +31 Setting up an electronic minimization →Creating the KPOINTS file
- 15:5815:58, 27 February 2025 diff hist +930 Setting up an electronic minimization No edit summary