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bsonghao / Thermal-Field

thermal field coupled cluster method: A new method for finite temperature electronic structure
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change the expression of two-body reduce matrix #25

Open bsonghao opened 2 years ago

bsonghao commented 2 years ago

27a5c4598c88c403c61fb40dc70cb624a30f41d5 implement the correction

bsonghao commented 2 years ago

image Changing the expression of 2-RDM does not improve the result