Outline of ASD_DMRG in place, now to start filling in the hard parts.
prepare inputs for growing the chain
preparing data for CI calculations. Only partially verified.
References built properly and the first CI calculations seem to run okay. Now to build GammaTensors/DMRG_Blocks out of them.
Outline of ASD_DMRG in place, now to start filling in the hard parts.
prepare inputs for growing the chain
preparing data for CI calculations. Only partially verified.
References built properly and the first CI calculations seem to run okay. Now to build GammaTensors/DMRG_Blocks out of them.
Merge branch 'ASD-DMRG' of https://github.com/shiozaki/BAGEL into ASD-DMRG
First step in the DMRG algorithm done, including computing Gamma operators. Now to start growing the chain.
Merge branch 'master' into ASD-DMRG
using MatView directly rather than as a shared_ptr
Container class for the information pertaining to a block
CIStringSpace stores StringSets in a map now
Starting a RASSpace class to be used in a product CI vector
implements RASCivecView
rearranging a bit
separating the organizing functions of BlockKey from the information storing, thus making BlockInfo
first stab at a storage class for ProductRASCI
name change