Pinned Repositories
quemb
QuEmb is an open-source tool for efficient quantum chemistry simulation of large molecules and solids (1D and 2D periodic systems) via bootstrap embedding technique.
achemso
LaTeX class for submissions to the American Chemical Society (ACS), and BibTeX styles for all ACS journals
pyblock3-fork
Fork of hczhai's "pyblock3".
QuEmb2
QuEmb is an open-source tool for efficient quantum chemistry simulation of large molecules and solids (1D and 2D periodic systems) via bootstrap embedding technique.
quemb
QuEmb is an open-source tool for efficient quantum chemistry simulation of large molecules and solids (1D and 2D periodic systems) via bootstrap embedding technique.
ShaunWeatherly's Repositories
ShaunWeatherly/achemso
LaTeX class for submissions to the American Chemical Society (ACS), and BibTeX styles for all ACS journals
ShaunWeatherly/pyblock3-fork
Fork of hczhai's "pyblock3".
ShaunWeatherly/QuEmb2
QuEmb is an open-source tool for efficient quantum chemistry simulation of large molecules and solids (1D and 2D periodic systems) via bootstrap embedding technique.