User contributions for Vaspmaster
23 June 2019
- 20:2420:24, 23 June 2019 diff hist +1 Cd Si volume relaxation →Calculation
- 20:1820:18, 23 June 2019 diff hist −4 Fcc Si →Calculation
- 20:1120:11, 23 June 2019 diff hist +1 CO vibration →{{TAG|INCAR}}
- 20:1120:11, 23 June 2019 diff hist −10 CO vibration →{{TAG|INCAR}}
- 20:1120:11, 23 June 2019 diff hist −17 CO vibration →{{TAG|INCAR}}
- 20:1020:10, 23 June 2019 diff hist +98 CO vibration →{{TAG|INCAR}}
- 20:0620:06, 23 June 2019 diff hist +71 O dimer →stdout
- 20:0420:04, 23 June 2019 diff hist −1 O dimer →stdout
- 20:0120:01, 23 June 2019 diff hist 0 O atom spinpolarized low symmetry →Calculation
- 19:0819:08, 23 June 2019 diff hist +11 ICAMM Rennes 2019 →Further Examples
- 19:0719:07, 23 June 2019 diff hist −150 ICAMM Rennes 2019 →Further Examples
- 19:0519:05, 23 June 2019 diff hist +148 Vibrational frequencies of CO on Ni 111 surface →Calculation
- 19:0319:03, 23 June 2019 diff hist +74 Vibrational frequencies of CO on Ni 111 surface →Calculation
- 19:0019:00, 23 June 2019 diff hist +147 Vibrational frequencies of CO on Ni 111 surface →{{TAG|POSCAR}}
- 18:5918:59, 23 June 2019 diff hist +9 Vibrational frequencies of CO on Ni 111 surface →{{TAG|POSCAR}}
- 18:5718:57, 23 June 2019 diff hist +12 Partial DOS of CO on Ni 111 surface →{{TAG|POSCAR}}
- 18:5718:57, 23 June 2019 diff hist +18 Partial DOS of CO on Ni 111 surface →{{TAG|POSCAR}}
- 18:5618:56, 23 June 2019 diff hist +117 Partial DOS of CO on Ni 111 surface →{{TAG|POSCAR}}
- 18:4818:48, 23 June 2019 diff hist +7 Ni 111 surface high precision →Calculation
- 18:4318:43, 23 June 2019 diff hist +8 Ni 100 surface bandstructure →Calculation
- 18:3018:30, 23 June 2019 diff hist −321 ICAMM Rennes 2019 →Further Examples
- 18:1418:14, 23 June 2019 diff hist +2 ICAMM Rennes 2019 →Magnetism in NiO
- 18:1318:13, 23 June 2019 diff hist +233 ICAMM Rennes 2019 →Further Examples
- 18:1018:10, 23 June 2019 diff hist +9 Constrained MD using a microcanonical ensemble No edit summary current
- 18:1018:10, 23 June 2019 diff hist +9 Constrained MD using a canonical ensemble No edit summary current
- 18:0718:07, 23 June 2019 diff hist +9 Standard relaxation No edit summary current
- 18:0518:05, 23 June 2019 diff hist +5 ICAMM Rennes 2019 →Relaxation and MD
- 18:0418:04, 23 June 2019 diff hist +23 ICAMM Rennes 2019 No edit summary
- 18:0318:03, 23 June 2019 diff hist +2 ICAMM Rennes 2019 →NMR calculations
- 18:0318:03, 23 June 2019 diff hist +2 ICAMM Rennes 2019 →Relaxation and MD
- 18:0318:03, 23 June 2019 diff hist +1 ICAMM Rennes 2019 →NMR calculations
- 18:0118:01, 23 June 2019 diff hist +28 ICAMM Rennes 2019 →Tutorials
- 18:0018:00, 23 June 2019 diff hist +127 ICAMM Rennes 2019 →Tutorials
- 17:5817:58, 23 June 2019 diff hist +36 Adsorption of H2O on TiO2 No edit summary
- 17:5217:52, 23 June 2019 diff hist +485 N Adsorption of H2O on TiO2 Created page with "== Task == In this example you will determine the transition state in the flipping of NH<sub>3</sub> by means of the Nudged-Elastic-Band (NEB) Method and the Improved Dimer M..."
- 17:4217:42, 23 June 2019 diff hist +9 Relaxed geometry No edit summary current
- 17:4117:41, 23 June 2019 diff hist +9 Vibrational Analysis of the TS No edit summary current
- 17:4017:40, 23 June 2019 diff hist +9 TS search using the NEB Method No edit summary current
- 17:3817:38, 23 June 2019 diff hist +9 TS search using the Improved Dimer Method No edit summary current
- 17:3217:32, 23 June 2019 diff hist −2 Transition State Search of Ammonia →Download
- 17:3117:31, 23 June 2019 diff hist −37 Transition State Search of Ammonia No edit summary
- 17:3017:30, 23 June 2019 diff hist +159 Transition State Search of Ammonia →Download
- 17:2917:29, 23 June 2019 diff hist +11 Transition State Search of Ammonia →Task
- 17:1617:16, 23 June 2019 diff hist +339 N Transition State Search of Ammonia Created page with "== Task == *[http://www.vasp.at/vasp-workshop/tutorials/tutorial_ammonia_flipping.pdf Ammonia Flipping]: A description of the examples "Transition State Search methods". ==..."
22 June 2019
- 23:5223:52, 22 June 2019 diff hist +120 N MediaWiki:Common.css Created page with "→CSS placed here will be applied to all skins: →prevent ugly horizontal page expansion: pre { overflow: auto; }" current
- 23:2323:23, 22 June 2019 diff hist +11 Equilibrium volume of Si in the RPA →Download
- 23:2223:22, 22 June 2019 diff hist +11 CRPA of SrVO3 →Downloads
- 23:2223:22, 22 June 2019 diff hist +11 Bandstructure of SrVO3 in GW →Download
- 23:2023:20, 22 June 2019 diff hist +10 Bandstructure of Si in GW (VASP2WANNIER90) →Download
- 23:1923:19, 22 June 2019 diff hist +10 Bandgap of Si in GW No edit summary