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- 12:48, 15 November 2022 diff hist +10 Main Page current Tag: Visual edit: Switched
- 18:11, 15 March 2022 diff hist +81 Solution LAB3 hBN current Tag: Visual edit: Switched
- 18:07, 15 March 2022 diff hist -46 Solution LAB3 hBN Tag: Visual edit: Switched
- 18:03, 15 March 2022 diff hist +20 Solution LAB3 hBN
- 16:22, 23 November 2021 diff hist +105 Scripting →Bash control statements current
- 12:49, 16 November 2021 diff hist +6 Getting Started →Machine setup current
- 12:49, 16 November 2021 diff hist +38 Getting Started →Machine setup
- 09:37, 30 April 2021 diff hist +108 Usage of a HPC cluster →Environment current
- 09:36, 30 April 2021 diff hist 0 Usage of a HPC cluster →Environment
- 09:29, 30 April 2021 diff hist +1,166 Usage of a HPC cluster
- 09:17, 30 April 2021 diff hist -1 Usage of a HPC cluster →Structure of a HPC cluster
- 09:17, 30 April 2021 diff hist 0 N File:Summit-ONL.jpg current
- 09:16, 30 April 2021 diff hist +221 Usage of a HPC cluster →Structure of a HPC cluster
- 09:10, 30 April 2021 diff hist +26 Usage of a HPC cluster →Structure of a HPC cluster
- 09:09, 30 April 2021 diff hist +482 Usage of a HPC cluster →Structure of a HPC cluster
- 09:03, 30 April 2021 diff hist -1 Usage of a HPC cluster →Structure of a HPC cluster
- 09:03, 30 April 2021 diff hist -6 Usage of a HPC cluster →Structure of a HPC cluster
- 09:03, 30 April 2021 diff hist -2 Usage of a HPC cluster →Structure of a HPC cluster
- 08:37, 30 April 2021 diff hist +60 Usage of a HPC cluster
- 08:37, 30 April 2021 diff hist +60 Usage of a HPC cluster →Structure of a HPC cluster
- 08:35, 30 April 2021 diff hist +88 N File:Structure HPC cluster.png structure of a HPC cluster. source: https://www.keralauniversity.ac.in/hpc current
- 08:33, 30 April 2021 diff hist +92 N File:Logical structure HPC cluster.png Logical structure of a HPC cluster. source: https://docs.hpc.qmul.ac.uk/intro/ current
- 08:32, 30 April 2021 diff hist +298 Usage of a HPC cluster Tag: Visual edit: Switched
- 08:24, 30 April 2021 diff hist +129 N Usage of a HPC cluster Created page with " Here we collect some general (and by no means complete) information about usage and policies of a HPC cluster. ** Connecting **"
- 08:22, 30 April 2021 diff hist +93 Getting Started →Opt2: Connecting to existing machines
- 13:18, 26 March 2021 diff hist 0 Solution LAB2 guanine 4
- 13:18, 26 March 2021 diff hist +92 Solution LAB2 guanine 4
- 13:16, 26 March 2021 diff hist +38 N File:Guanine HOMO.png plot of the guanine HOMO current
- 12:58, 26 March 2021 diff hist +603 N Solution LAB2 guanine 4 Created page with " * Back to the previous page: Electronic properties of isolated molecules#Exercise 4 An example of input file for <code>pp.x</code> to plot the HOMO of guanine (pp_HOMO.i..."
- 12:56, 26 March 2021 diff hist +37 Electronic properties of isolated molecules →Exercises
- 12:44, 26 March 2021 diff hist +2 Electronic properties of isolated molecules →Exercises
- 12:42, 26 March 2021 diff hist +4 Electronic properties of isolated molecules →Exercise 4
- 12:36, 26 March 2021 diff hist +147 Solution LAB2 guanine 3 current
- 12:33, 26 March 2021 diff hist +447 Solution LAB2 guanine 3
- 11:52, 26 March 2021 diff hist +10 Solution LAB2 guanine 3
- 11:52, 26 March 2021 diff hist +116 Solution LAB2 guanine 3
- 11:28, 26 March 2021 diff hist +1,003 Solution LAB2 guanine current
- 10:54, 26 March 2021 diff hist +151 Electronic properties of isolated molecules →Exercise 1
- 00:14, 19 March 2021 diff hist +2 Electronic properties of isolated molecules →Exercise 3
- 00:13, 19 March 2021 diff hist +647 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 00:06, 19 March 2021 diff hist 0 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 00:05, 19 March 2021 diff hist 0 N File:PWL plot.png current
- 00:05, 19 March 2021 diff hist +39 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 00:04, 19 March 2021 diff hist +1 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 00:04, 19 March 2021 diff hist -2 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 00:04, 19 March 2021 diff hist +850 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 23:46, 18 March 2021 diff hist -78 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 23:38, 18 March 2021 diff hist -5 Electronic properties of isolated molecules →Janak's theorem, Piece-wise Linearity, Ionization potential
- 23:38, 18 March 2021 diff hist +494 Electronic properties of isolated molecules
- 23:23, 18 March 2021 diff hist +6 Electronic properties of isolated molecules →Exercise 5
- 23:18, 18 March 2021 diff hist +244 Electronic properties of isolated molecules →Post processing tools
- 23:17, 18 March 2021 diff hist +164 Electronic properties of isolated molecules →Post processing tools
- 22:36, 18 March 2021 diff hist +689 Electronic properties of isolated molecules →Post processing tools
- 21:00, 18 March 2021 diff hist +1 Electronic properties of isolated molecules →Post processing tools
- 21:00, 18 March 2021 diff hist +881 Electronic properties of isolated molecules →Post processing tools
- 20:44, 18 March 2021 diff hist +63 Electronic properties of isolated molecules →Exercise1
- 20:41, 18 March 2021 diff hist +3 Electronic properties of isolated molecules →Exercise1
- 20:41, 18 March 2021 diff hist 0 Solution LAB2 guanine →Step 1
- 20:39, 18 March 2021 diff hist 0 N File:Snapshot avogadro.png current
- 20:38, 18 March 2021 diff hist +48 Solution LAB2 guanine →Step 1
- 20:37, 18 March 2021 diff hist +8 Solution LAB2 guanine →Step 2
- 20:36, 18 March 2021 diff hist +76 Solution LAB2 guanine →Step 1
- 20:22, 18 March 2021 diff hist +2 Electronic properties of isolated molecules →Exercises
- 20:15, 18 March 2021 diff hist 0 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 20:14, 18 March 2021 diff hist +6 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 20:13, 18 March 2021 diff hist -1 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 20:13, 18 March 2021 diff hist +1,112 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 19:58, 18 March 2021 diff hist +17 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 19:56, 18 March 2021 diff hist +1,785 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 19:20, 18 March 2021 diff hist 0 Electronic properties of isolated molecules
- 19:18, 18 March 2021 diff hist +48 Electronic properties of isolated molecules
- 19:09, 18 March 2021 diff hist +93 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 19:05, 18 March 2021 diff hist 0 N File:Molecule imaging.png current
- 19:04, 18 March 2021 diff hist 0 N File:Molecule cartoon.png current
- 18:39, 18 March 2021 diff hist +135 Plotting and visualization tools →Avogadro current
- 13:21, 18 March 2021 diff hist +59 Electronic properties of isolated molecules →Calculation of molecules: Intro
- 13:19, 18 March 2021 diff hist +6 Electronic properties of isolated molecules
- 13:15, 18 March 2021 diff hist +1,290 Electronic properties of isolated molecules
- 12:39, 18 March 2021 diff hist +6 Getting Started →Opt1: Using Quantum Mobile
- 12:38, 18 March 2021 diff hist +141 Getting Started →Opt1: Using Quantum Mobile
- 16:00, 16 December 2020 diff hist +7 Solution LAB1 bands DOS diamond →Band structure of Diamond current
- 16:00, 16 December 2020 diff hist +38 Solution LAB1 bands DOS diamond →Band structure of Diamond
- 15:59, 16 December 2020 diff hist +70 Solution LAB1 bands DOS diamond
- 15:59, 16 December 2020 diff hist -1 Solution LAB1 bands DOS diamond →Preliminaries
- 15:58, 16 December 2020 diff hist +258 Solution LAB1 bands DOS diamond →Band structure of Diamond
- 15:57, 16 December 2020 diff hist 0 N File:Common-Brillouin-zone-of-diamond-and-zinc-blende-semiconductors Q640.jpg current
- 15:33, 16 December 2020 diff hist +460 Non self-consistent calculations: Band structures and Density Of States →Examples and Exercises
- 15:26, 16 December 2020 diff hist 0 Solution LAB1 bands DOS diamond →Band structure of Diamond
- 15:26, 16 December 2020 diff hist 0 Solution LAB1 bands DOS diamond →Band structure of Diamond
- 15:25, 16 December 2020 diff hist 0 N File:Bands diamond.jpg current
- 15:23, 16 December 2020 diff hist +305 Solution LAB1 bands DOS diamond
- 15:10, 16 December 2020 diff hist +19 Solution LAB1 diamond bulk modulus →Bulk modulus of diamond current
- 15:09, 16 December 2020 diff hist +851 Solution LAB1 diamond bulk modulus →Bulk modulus of diamond
- 14:20, 16 December 2020 diff hist +933 N Solution LAB1 diamond bulk modulus Created page with " * Back to the previous page: Structural and electronic properties of semiconductors and metals #Convergences ===Bulk modulus of diamond=== Using the data produced in th..."
- 14:12, 16 December 2020 diff hist +16 Solution LAB1 diamond lattice parameter →Results as a function of the cutoff current
- 14:11, 16 December 2020 diff hist +30 Solution LAB1 diamond lattice parameter →Results as a function of the cutoff
- 14:09, 16 December 2020 diff hist 0 Solution LAB1 diamond lattice parameter →Results as a function of the cutoff
- 14:08, 16 December 2020 diff hist +36 Solution LAB1 diamond lattice parameter →Results as a function of the cutoff
- 14:04, 16 December 2020 diff hist -24 Solution LAB1 diamond lattice parameter →Results as a function of the cutoff
- 14:02, 16 December 2020 diff hist +432 Solution LAB1 diamond lattice parameter →Results as a function of the cutoff