# HF: maxSCF thresh DIIS n_diis guess_type ortho_type mix_guess level_shift stability 256 0.0000001 T 5 2 1 F 0.0 F # MP: # CC: maxSCF thresh DIIS n_diis 64 0.00001 T 5 # spin: TDA singlet triplet spin_conserved spin_flip T T T T T # GF: maxSCF thresh DIIS n_diis lin eta renorm reg 256 0.00001 T 5 T 0.0 3 F # GW: maxSCF thresh DIIS n_diis lin eta COHSEX SOSEX TDA_W G0W GW0 reg 256 0.00001 T 5 T 0.0 F F F F F F # GT: maxSCF thresh DIIS n_diis lin eta TDA_T reg 256 0.00001 T 5 T 0.0 F F # ACFDT: AC Kx XBS F F T # BSE: BSE dBSE dTDA evDyn T T T F # MCMP2: nMC nEq nWalk dt nPrint iSeed doDrift 1000000 100000 10 0.3 10000 1234 T