issues
search
eljost
/
nddia
N/D diabatiziation of adiabatic potential energy curves.
GNU Lesser General Public License v3.0
1
stars
0
forks
source link
adiabatic
diabatic
diabatziation
excited-states
quantum-chemistry
readme
nddia
Direct diabatization based on nonadiabaticcouplings: the N/D method
according to
10.1039/c8cp03410a