def analyze(self):
"""
read ao overlap matrix
"""
myjob = gms_parser(self.config)
myjob.get_ao()
return
def analyze(self):
"""
read ao overlap matrix
"""
myjob = gms_parser(self.config)
myjob.get_ao()
return
def analyze(self):
"""
for surface hopping like calc., the required QC information was extraced.
"""
gms = gms_parser(self.config)
# @check correction first
gms.get_td_dat()
return
def analyze(self):
"""
for surface hopping like calc., the required QC information was extraced.
"""
gms = gms_parser(self.config)
# @check correction first
gms.get_td_dat()
return
def analyze(self):
"""
extract data used for surface hopping dynamics.,
the required QC information was extraced.
"""
parser = gms_parser(self.config)
# @check correction first
parser.get_td_dat()
return
def analyze(self):
"""
extract data used for surface hopping dynamics.,
the required QC information was extraced.
"""
parser = gms_parser(self.config)
# @check correction first
parser.get_td_dat()
return
