diceplayer:
    opt: no
    mem: 24
    maxcyc: 10
    ncores: 5
    nprocs: 4
    qmprog: 'g16'
    lps: no
    ghosts: no
    altsteps: 20000

    dice:
        nmol: [1, 1000]
        dens: 1.0
        nstep: [2000, 3000]
        isave: 1000
        outname: 'phb'
        progname: '~/.local/bin/dice'
        ljname: 'phb.ljc'
        randominit: 'first'

    gaussian:
        qmprog: 'g16'
        level: 'MP2/aug-cc-pVDZ'