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Merge from upstream#2

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huanghua1994 merged 21 commits intohuanghua1994:masterhuanghua1994/simint-generator:masterfrom simint-chem:mastersimint-chem/simint-generator:masterCopy head branch name to clipboardDec 14, 2018

+3,090-12

Commits

Commits on Feb 28, 2018

• Merge pull request #4 from huanghua1994/master

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  echow

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Commits on Mar 8, 2018

• Merge pull request #5 from huanghua1994/master

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  echow

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Commits on Apr 14, 2018

• Merge pull request #7 from huanghua1994/master

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  echow

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• Merge pull request #5 from gtfock-chem/master

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  echow

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Commits on Apr 27, 2018

• add gamess-ordered gindex map

  keipertk

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Commits on Jun 16, 2018

• Adding fortran interface for 1-electron terms

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  colleeneb

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Commits on Jul 3, 2018

• Fix for segv when no screening is used. Could fix #7. More testing is needed

  edoapra

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Commits on Jul 6, 2018

• fix for uninitialized elements when vector length is not a multiple of SIMD_LEN

  edoapra

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• initialization of P->screen_max moved up

  edoapra

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• removed second declaration of int n

  edoapra

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• fix for bug introduced in bc83ddd: set shell.screen_max to large value (not zero)

  edoapra

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• initialization of bra_screen_max to zero required when using scalar approach

  edoapra

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Commits on Jul 17, 2018

• Removing allocation of eri workspace in simint_primscreen_fastschwarz

  colleeneb

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Commits on Jul 27, 2018

• Removing workspace comment

  colleeneb

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• Merge pull request #11 from colleeneb/fastschwarz_mem

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Commits on Jul 28, 2018

• Merge pull request #6 from keipertk/gmsOrdering

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  echow

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• Merge pull request #8 from colleeneb/onee_fortran

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• Merge pull request #10 from edoapra/master

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Commits on Nov 4, 2018

• Change in ostei to free pointer

  colleeneb

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Commits on Nov 8, 2018

• Removing the check on if its NULL

  colleeneb

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Commits on Dec 11, 2018

• Merge pull request #13 from colleeneb/mem_issue

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