User contributions for Dmitri

Results for Dmitri talk block log uploads logs

A user with 1,978 edits. Account created on 10 January 2020.

Jump to navigation Jump to search

16:5316:53, 8 October 2025 diff hist +4 How to work with large number of small files →Local File systems on the Node

21:1621:16, 3 October 2025 diff hist +1 ORCA →ORCA on ARC current
21:1521:15, 3 October 2025 diff hist +234 ORCA →ORCA on ARC
20:5420:54, 3 October 2025 diff hist +15 ORCA →ORCA on ARC
20:3720:37, 3 October 2025 diff hist −2 ORCA →Job script
20:3720:37, 3 October 2025 diff hist +641 ORCA →Job script
20:3520:35, 3 October 2025 diff hist +2 ORCA →ORCA on ARC
20:3420:34, 3 October 2025 diff hist +201 ORCA →ORCA on ARC

22:0722:07, 1 October 2025 diff hist +276 Book online training sessions →Book your training session here

22:4522:45, 26 September 2025 diff hist +62 ARC Software →Chemistry current
22:2622:26, 26 September 2025 diff hist +132 CP2K →Multi-process MPI job on one node current
22:2322:23, 26 September 2025 diff hist −2,434 CP2K →Running CP2K jobs using containers
22:1322:13, 26 September 2025 diff hist −3 CP2K →Running CP2K jobs using containers
21:4921:49, 26 September 2025 diff hist 0 CP2K →Mixed MPI/OpenMP job on one node
21:4821:48, 26 September 2025 diff hist +24 CP2K →Mixed MPI/OpenMP job on one node
21:4821:48, 26 September 2025 diff hist +24 CP2K →Multi-process MPI job on one node
21:4821:48, 26 September 2025 diff hist −280 CP2K →Shared memory OpenMP job
21:4721:47, 26 September 2025 diff hist +304 CP2K →Shared memory OpenMP job
21:3321:33, 26 September 2025 diff hist +2 CP2K →Mix MPI/OpenMP job on one node
21:3221:32, 26 September 2025 diff hist +19 CP2K →Multi-process MPI job on one node
21:3121:31, 26 September 2025 diff hist +2 CP2K →Multi-process MPI job on one node
21:3021:30, 26 September 2025 diff hist +1,233 CP2K →Running CP2K jobs using containers
21:1821:18, 26 September 2025 diff hist +472 CP2K →Running CP2K jobs using containers
21:1221:12, 26 September 2025 diff hist +1,545 CP2K →Running CP2K jobs using containers
20:4820:48, 26 September 2025 diff hist +243 CP2K →CP2K Examples
20:0120:01, 26 September 2025 diff hist +106 CP2K →CP2K Examples
19:5819:58, 26 September 2025 diff hist +535 CP2K →Links

21:2721:27, 23 September 2025 diff hist +147 List of courses on TALC →Winter 2026

22:1122:11, 16 September 2025 diff hist +93 CP2K →CP2K Official Containers
22:0122:01, 16 September 2025 diff hist −1 CP2K →Running commands from the containers
22:0122:01, 16 September 2025 diff hist +660 CP2K →CP2K Official Containers

20:1820:18, 15 September 2025 diff hist +761 CP2K →Running commands from the containers
20:0820:08, 15 September 2025 diff hist +161 CP2K →Running commands from the containers
19:4919:49, 15 September 2025 diff hist +491 CP2K →CP2K Official Containers
18:1318:13, 15 September 2025 diff hist −3 CP2K →CP2K Official Containers
18:1118:11, 15 September 2025 diff hist +131 CP2K →CP2K Official Containers
18:1018:10, 15 September 2025 diff hist +291 CP2K →Natively Installed CP2K
17:5717:57, 15 September 2025 diff hist +774 CP2K →Natively Installed CP2K
17:5117:51, 15 September 2025 diff hist +193 CP2K →CP2K on ARC
17:4717:47, 15 September 2025 diff hist +2 CP2K →CP2K on ARC
17:4717:47, 15 September 2025 diff hist +126 CP2K →CP2K on ARC
17:4517:45, 15 September 2025 diff hist +32 CP2K →CP2K on ARC
17:4417:44, 15 September 2025 diff hist +196 CP2K →CP2K Official Containers
17:4217:42, 15 September 2025 diff hist +278 CP2K →CP2K Official Containers
17:4117:41, 15 September 2025 diff hist +219 CP2K →Links
17:3817:38, 15 September 2025 diff hist +17 CP2K →Types of Executable files
17:3717:37, 15 September 2025 diff hist +738 CP2K →Background
17:3617:36, 15 September 2025 diff hist +919 N CP2K Created page with "= Background = CP2K is a quantum chemistry and solid state physics software package that can perform atomistic simulations of solid state, liquid, molecular, periodic, material, crystal, and biological systems. CP2K provides a general framework for different modeling methods such as DFT using the mixed Gaussian and plane waves approaches GPW and GAPW. Supported theory levels include DFT, MP2, RPA, GW, tight-binding (xTB, DFTB), semi-empirical methods (AM1, PM3, PM6, R..."
17:3617:36, 15 September 2025 diff hist +15 ARC Software →Chemistry

19:2819:28, 8 September 2025 diff hist +276 Book online training sessions →Book your training session here

Retrieved from "https://rcs.ucalgary.ca/Special:Contributions/Dmitri"