I’m trying to do VQCCD
I’m using following input
$molecule
0 3
O
O 1 1.20
$end
$rem
JOBTYPE sp
METHOD vqccd
BASIS 6-31G
SCF_CONVERGENCE 9
THRESH 12
CC_PRECONV_T2Z 50
CC_PRECONV_T2Z_EACH 50
CC_DOV_THRESH 7500
CC_THETA_STEPSIZE 3200
CC_DIIS_START 75
$end
But I facing this error
CCMAN error!BlockTensor::CheckAndAdjustForContract(): invalid result BlockTensorremove