amberbot2017 commit: AWG: MRCC interface commit 472dc3b57349e2efab444695f4d0fc757d1d8fe0
amberbot2017 commit: AWG: MRCC interface
commit 472dc3b57349e2efab444695f4d0fc757d1d8fe0

Date:   Wed Mar 1 01:04:44 2017 -0800
    AWG: MRCC interface

    Squashed commit of the following:

    commit 35ae78ef1c558eb3a576d856d4c013b61fa1c6c3
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Wed Mar 1 01:01:29 2017 -0800

        AWG: Update author comment in mrcc module

    commit c2d9d371c240c1b9e5a5010bfc28f6fa9ed69bf8
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Wed Mar 1 00:58:18 2017 -0800

        AWG: Add MRCC section to manual

    commit 919ead6a6280fa9d95f9f0592e4c740394ee7f53
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Wed Mar 1 00:57:55 2017 -0800

        AWG: update MRCC default basis set

    commit c7aac6465d14ae1da50d48ec2e0ca97cafc56727
    Merge: 24e262f 9d84289
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Tue Feb 28 19:52:42 2017 -0800

        Merge branch master into mrcc-interface

    commit 24e262f8616adbcf2d4cbf08cda22e5e96e1ddc6
    Merge: 926e2a6 e7b976e
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Wed Feb 22 19:05:46 2017 -0800

        Merge branch master into mrcc-interface

    commit 926e2a69616cec5a40f3dc194be3152f8de6a428
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Thu Feb 16 01:54:58 2017 -0500

        AWG: Add QM/MM tests for MRCC

    commit 597af1127c36e15985492164152b6278ec891c04
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Thu Feb 16 01:39:18 2017 -0500

        AWG: Update test Makefile for MRCC pure QM MD tests

    commit 887b3deb31c0849f13719b164404474b35d2b8bd
    Author: Andreas Goetz <agoetz@sdsc.edu>
    Date:   Thu Feb 16 01:34:42 2017 -0500

        AWG: Add MRCC interface (link atom based)

        Based on EXTERN module
        Code was contributed by Bence Hegely

        AWG fixed a bug writing MRCC input files, tested for
        pure QM MD geometry optimization and MD and added pure QM MD tests

Amber-MD/ambertools-ci