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Libcint 6.0.0
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@sunqm sunqm released this 28 Sep 05:48
· 11 commits to master since this release
v6.0.0
6ec14b3
  • Add polynomial root finder using the eigenvalue algorithm
  • Fitting Rys roots of SR integrals with Chebyshev polynomials
  • Remove GTG integrals which are erroneous in previous versions
  • Remove coulerf integrals which has been covered by regular int2e functions
Assets 2
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