from siman.calculators.vasp import CalculationVasp
cl = CalculationVasp(output = 'in/test_OUTCAR')
# cl.cluster = {}
# cl.cluster['address'] = ''
cl.read_results(show = 'fo')
cl.res(show = 'fo')
-- Attention!, No CONTCAR: in/test_CONTCAR . I use data from outcar -- Attention!, No CONTCAR: in/test_CONTCAR . I use data from outcar -- | energy(eV)| Vector lenghts (A) | Stresses (MPa) | N MD, N SCF Max. F. tot (meV/A) = [54] -- db['noname'] |noname| -71.2875 |5.01, 5.01, 5.50| -4828,-4828,-4677 | 15,10,150