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Commits on Oct 4, 2020

• Fix bug in gmp2 tests

  sunqm

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  546c119

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Commits on Jun 19, 2020

• Add tddft example

  sunqm

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Commits on Jan 25, 2020

• Add equilibrium solvation for ddCOSMO-TDDFT (issue pyscf#485)

  sunqm

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  e9e6507

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Commits on Jan 24, 2020

• Update tddft example

  sunqm

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Commits on Aug 20, 2019

• Merge branch 'master' of https://github.com/pyscf/pyscf into dev

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  sunqm

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Commits on Aug 16, 2019

• Fix a bug caused by the range type difference between python2 and python3 (issue pyscf#405)

  sunqm

  committed
  673f1d9

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Commits on Aug 13, 2019

• Merge branch 'master' of ssh://github.com/sunqm/pyscf into dev

  sunqm

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  4a229d5

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• Add example for tddft excited state density

  sunqm

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  9b313ed

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Commits on Jul 28, 2019

• Fix tddft example

  sunqm

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Commits on Jul 27, 2019

• Example to compute CIS energy transfer coupling matrix

  sunqm

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Commits on Feb 8, 2019

• Register more methods in SCF class

  sunqm

  committed
  84ea044

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Commits on May 4, 2018

• Update dft tests

  sunqm

  committed
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Commits on Mar 21, 2018

• Added TD-UKS analyze method

  sunqm

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Commits on Mar 19, 2018

• Added TDDFT NTO analysis

  sunqm

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Commits on Mar 10, 2018

• Export A, B matrices in tddft

  sunqm

  committed
  984d059

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Commits on Aug 8, 2017

• Improve error message if XC functional derivative is not supported in libxc

  sunqm

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Commits on Aug 1, 2017

• Add tddft example

  sunqm

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