Dear QE users
Dear i am new in DFT calculation ( i use quantum espresso) , now i am using epsilon.x input to find optical properties. i have write the following input : &inputpp outdir = './out/' prefix = 'aiida' calculation = 'eps' / &ENERGY_GRID smeartype = 'gauss' intersmear =0.1 intrasmear = 0.0 wmax = 10.0 wmin = 0.0 nw = 500 shift = 0.0 / but i have the following error : task # 0 from epsilon : error # 5010 reading namelist ENERGY_GRID can you please help me to solve/undrestand the origin of the error ?? Best regards Thanks
_______________________________________________ The Quantum ESPRESSO community stands by the Ukrainian people and expresses its concerns about the devastating effects that the Russian military offensive has on their country and on the free and peaceful scientific, cultural, and economic cooperation amongst peoples _______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
