Dear Team
I am running the first example of h2 and it gives error in macos . Please suggest what to do This is my input file &control calculation = 'relax' prefix = 'h2' pseudo_dir = '/Users/damianlabmac1/Documents/Monika/SSSP_1.3.0_PBE_efficiency' / &system ibrav = 1, celldm(1) = 25, nat = 2, ntyp = 1, ecutwfc = 30.0 / &electrons conv_thr = 1e-8 / &ions ion_dynamics = 'bfgs' / ATOMIC_SPECIES H 1.00784 H.pbe-rrkjus_psl.1.0.0.UPF ATOMIC_POSITIONS (angstrom) H 0.00 0.00 0.00 H 1.00 0.00 0.00 K_POINTS (automatic) 1 1 1 0 0 0 My CRASh file %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% task # 0 from set_dft_from_name : error # 1 : unrecognized dft %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% task # 2 from set_dft_from_name : error # 1 : unrecognized dft %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% My output file\ Program PWSCF v.7.4.1 starts on 9Jun2025 at 11:18: 7 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017); "P. Giannozzi et al., J. Chem. Phys. 152 154105 (2020); URL http://www.quantum-espresso.org";, in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 4 processors MPI processes distributed on 1 nodes 0 MiB available memory on the printing compute node when the environment starts Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 4 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% Error in routine set_dft_from_name (1): : unrecognized dft %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% stopping …
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