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Segmentation fault when sampling determinants

3

Hi, I am revisiting the calculations from Issue #52 . I am trying to do the same thing (sampling the CI determinant coefficients) for a bigger system, but the program...

davidsousarj

GPU implementation of block2

2

Hello, Thank you for the great library. I am not so familiar with the DMRG algorithm and block2 implementation so I am curious if there is a GPU implementation of...

hungpham2017

onepdms for SOC calc

1

Hi, I am trying to calculate the onepdm for soc calc in our C++ code using block2. It's the same code as mentioned in #72. We have an adapted version...

GuriTheoChem