Blog Archive 2017 Electronic Structure Workshop in Linköping Feb 24 2017 2016 ISC’16 Conference Jun 16 2016 Paper highlight: Reproducibility of DFT calculations of solids Jun 15 2016 2015 Running VASP on Nvidia GPUs Nov 16 2015 SC15 conference Nov 11 2015 New version of VASP - 5.4.1 Sep 21 2015 VASP seminar at Uppsala University Jan 14 2015 VASP on Cray XC-40 Beskow: preliminary benchmark results Jan 13 2015 Selecting the right number of cores for a VASP calculation Jan 12 2015 How to compile VASP on the Cray XC40 Jan 07 2015 2014 Initial test of VASP on Intel’s Xeon E5 v3 processors (“Haswell”) Dec 16 2014 Visiting University of Antwerp Oct 22 2014 Application statistics for Triolith Sep 26 2014 Intel releases new “Haswell” Xeon server processors Sep 10 2014 Peak VASP calculations ahead? Jul 18 2014 Looking at the OpenMX DFT code Jun 11 2014 On long queue times May 15 2014 New version of VASP - 5.3.5 Apr 30 2014 How accurate are different DFT codes? Feb 21 2014 Live profiling on Triolith with “perf” Feb 06 2014 Running VASP on 9,216 cores Jan 30 2014 New version of the VASP test suite Jan 23 2014 2013 Quantum Espresso vs VASP (round 3) Dec 18 2013 SC13 conference Nov 13 2013 How to compile VASP 5.3.3 on Ubuntu 13.10 Nov 05 2013 Exploring quadruple precision floating point numbers in GCC and ICC Oct 17 2013 Shared memory communication vs Infiniband Sep 12 2013 Hardware recommendations for VASP Sep 04 2013 Aflow and Aconvasp Jul 02 2013 Auto-parallelization applied to the Elk LAPW code May 29 2013 Atomic Simulation Environment on Triolith May 21 2013 Compiling VASP with Gfortran May 14 2013 Scaling of small jobs on the Abisko Interlagos cluster Apr 05 2013 VASP on the Abisko cluster (with AMD Interlagos) Mar 25 2013 Making supercells for VASP Feb 26 2013 Quantum Espresso vs VASP (round 2) Feb 19 2013 Quantum Espresso vs VASP (round 1) Feb 04 2013 Tuning VASP: BLAS and FFT on Cray XE6 Jan 30 2013 How to compile VASP on Cray XE6 Jan 23 2013 Tuning VASP: fast Fourier transforms Jan 10 2013 How to compile VASP on NSC’s Triolith Jan 09 2013 2012 K-point parallelization in VASP, part 2 Nov 26 2012 VASP, ELPA, Lindgren and Triolith Oct 26 2012 Compiling VASP with the ELPA library Oct 25 2012 Testing the k-point parallelization in VASP Sep 26 2012 New version of VASP - 5.3.2 Sep 25 2012 VASP hybrid calculations on Triolith Jul 27 2012 Small VASP jobs on Triolith Jul 17 2012 Running VASP on Triolith Jul 10 2012 Triolith visualized May 29 2012 Understanding the limits of VASP parallel scaling May 14 2012 ABINIT vs VASP round 2 Apr 18 2012 Running big on Lindgren Mar 23 2012 ABINIT vs VASP round 1 Mar 01 2012 Optimizing NPAR and NSIM Feb 22 2012 2011 VASP and the NPAR setting Jun 30 2011 How to compile VASP Jun 28 2011