/tools/block2-preview

block2-preview

block-hczhai/block2-preview

98 stars30 forksC++Added February 8, 2026
summary

The block2 code provides an efficient implementation of DMRG for quantum chemistry, enabling advanced simulations of molecular systems. It supports various features for electronic structure calculations and is designed for high performance and scalability.

description

Efficient parallel quantum chemistry DMRG in MPO formalism

topics

density-matrix-renomalization-groupmatrix-product-statesdmrgquantum-chemistryab-initiomrcipyscfbose-hubbardheisenberg-modelfermi-hubbardtj-model

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