svn commit: r536433 - head/science/cp2k-data

[Yuri Victorovich]

Author: yuri
Date: Mon May 25 04:00:02 2020
New Revision: 536433
URL: https://svnweb.freebsd.org/changeset/ports/536433

Log:
  science/cp2k-data: Update 6.1.0 -> 7.1.0
  
  Reported by:	portscout

Modified:
  head/science/cp2k-data/Makefile
  head/science/cp2k-data/distinfo
  head/science/cp2k-data/pkg-plist

Modified: head/science/cp2k-data/Makefile
==============================================================================
--- head/science/cp2k-data/Makefile	Mon May 25 03:56:43 2020	(r536432)
+++ head/science/cp2k-data/Makefile	Mon May 25 04:00:02 2020	(r536433)
@@ -2,7 +2,7 @@
 
 PORTNAME=	cp2k-data
 DISTVERSIONPREFIX=	v
-DISTVERSION=	6.1.0
+DISTVERSION=	7.1.0
 CATEGORIES=	science
 
 MAINTAINER=	yuri at FreeBSD.org

Modified: head/science/cp2k-data/distinfo
==============================================================================
--- head/science/cp2k-data/distinfo	Mon May 25 03:56:43 2020	(r536432)
+++ head/science/cp2k-data/distinfo	Mon May 25 04:00:02 2020	(r536433)
@@ -1,3 +1,3 @@
-TIMESTAMP = 1554566037
-SHA256 (cp2k-cp2k-v6.1.0_GH0.tar.gz) = d7dd5f164e1e51d2dcb8c7d927b99f6ac1d0f8de4a665bd9daee1a14864c30ae
-SIZE (cp2k-cp2k-v6.1.0_GH0.tar.gz) = 63576088
+TIMESTAMP = 1577257727
+SHA256 (cp2k-cp2k-v7.1.0_GH0.tar.gz) = e244f76d7e1e98da7e4e4b2e6cefb723fa1205cfae4f94739413be74952e8b4e
+SIZE (cp2k-cp2k-v7.1.0_GH0.tar.gz) = 79174425

Modified: head/science/cp2k-data/pkg-plist
==============================================================================
--- head/science/cp2k-data/pkg-plist	Mon May 25 03:56:43 2020	(r536432)
+++ head/science/cp2k-data/pkg-plist	Mon May 25 04:00:02 2020	(r536433)
@@ -3,13 +3,15 @@
 %%DATADIR%%/BASIS_ADMM
 %%DATADIR%%/BASIS_ADMM_MOLOPT
 %%DATADIR%%/BASIS_LRIGPW_AUXMOLOPT
+%%DATADIR%%/BASIS_MINIX
 %%DATADIR%%/BASIS_MOLOPT
+%%DATADIR%%/BASIS_MOLOPT_LnPP1
 %%DATADIR%%/BASIS_MOLOPT_UCL
 %%DATADIR%%/BASIS_RI_cc-TZ
 %%DATADIR%%/BASIS_SET
 %%DATADIR%%/BASIS_ZIJLSTRA
 %%DATADIR%%/BASIS_def2_QZVP_RI_ALL
-%%DATADIR%%/BASIS_pob-TZVP
+%%DATADIR%%/BASIS_pob
 %%DATADIR%%/DFTB/nonscc/bb
 %%DATADIR%%/DFTB/nonscc/bc
 %%DATADIR%%/DFTB/nonscc/bh
@@ -82,6 +84,7 @@
 %%DATADIR%%/DFTB/scc/hh.spl
 %%DATADIR%%/DFTB/scc/hn.spl
 %%DATADIR%%/DFTB/scc/ho.spl
+%%DATADIR%%/DFTB/scc/ho_modi.spl
 %%DATADIR%%/DFTB/scc/hp.spl
 %%DATADIR%%/DFTB/scc/hs.spl
 %%DATADIR%%/DFTB/scc/hzn.spl
@@ -94,8 +97,10 @@
 %%DATADIR%%/DFTB/scc/nzn.spl
 %%DATADIR%%/DFTB/scc/oc.spl
 %%DATADIR%%/DFTB/scc/oh.spl
+%%DATADIR%%/DFTB/scc/oh_modi.spl
 %%DATADIR%%/DFTB/scc/on.spl
 %%DATADIR%%/DFTB/scc/oo.spl
+%%DATADIR%%/DFTB/scc/oo_modi.spl
 %%DATADIR%%/DFTB/scc/op.spl
 %%DATADIR%%/DFTB/scc/os.spl
 %%DATADIR%%/DFTB/scc/ozn.spl
@@ -127,6 +132,7 @@
 %%DATADIR%%/GTH_POTENTIALS
 %%DATADIR%%/HFX_BASIS
 %%DATADIR%%/HF_POTENTIALS
+%%DATADIR%%/LnPP1_POTENTIALS
 %%DATADIR%%/MM_POTENTIAL
 %%DATADIR%%/NLCC_POTENTIALS
 %%DATADIR%%/POTENTIAL
@@ -137,4 +143,14 @@
 %%DATADIR%%/t_c_g.dat
 %%DATADIR%%/t_sh_p_s_c.dat
 %%DATADIR%%/vdW_kernel_table.dat
+%%DATADIR%%/xTB_parameters
+%%DATADIR%%/xc_section/HF-3c.sec
 %%DATADIR%%/xc_section/PBE.sec
+%%DATADIR%%/xc_section/vdW-DF-cx.sec
+%%DATADIR%%/xc_section/vdW-DF-cx0p.sec
+%%DATADIR%%/xc_section/vdW-DF-optB88.sec
+%%DATADIR%%/xc_section/vdW-DF-optPBE.sec
+%%DATADIR%%/xc_section/vdW-DF1-C09.sec
+%%DATADIR%%/xc_section/vdW-DF1.sec
+%%DATADIR%%/xc_section/vdW-DF2-b86r.sec
+%%DATADIR%%/xc_section/vdW-DF2.sec