Hard times that we have to live I don’t think any of us are going to disagree, but we must show it to the world. We have to demonstrate, each of us (from home), that science and HPC are not …

HPC is much stronger than any virus! Read More »

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Project reference: 2014 The deMon2k (density of Montréal) [1] is a software package for density functional theory (DFT) calculations. It uses the linear combination of Gaussian-type orbital (LCGTO) approach for the self-consistent solution of the Kohn-Sham (KS) DFT equations.  RT-TDDFT …

Matrix exponentiation on GPU for the deMon2k code Read More »

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