hotfix do potencjalow AM1
authorAdam Kazimierz Sieradzan <adasko@sun1.chem.univ.gda.pl>
Thu, 5 Jul 2012 07:54:04 +0000 (03:54 -0400)
committerAdam Kazimierz Sieradzan <adasko@sun1.chem.univ.gda.pl>
Thu, 5 Jul 2012 07:54:04 +0000 (03:54 -0400)
.gitignore
source/unres/src_MD/COMMON.SCCOR

index 25485f3..c0b1de6 100644 (file)
@@ -17,3 +17,4 @@ mapcheck/
 run/
 sympcheck/
 compinfo
+DIL/
index ca6210f..ccfe0c4 100644 (file)
@@ -6,7 +6,7 @@ cc Parameters of the SCCOR term
       integer nterm_sccor,isccortyp,nsccortyp,nlor_sccor
       common/sccor/v1sccor(maxterm_sccor,3,20,20),
      &    v2sccor(maxterm_sccor,3,20,20),
-     &    v0sccor(maxterm_sccor,20),
+     &    v0sccor(ntyp,ntyp),
      &    nterm_sccor(ntyp,ntyp),isccortyp(ntyp),nsccortyp,
      &    nlor_sccor(ntyp,ntyp),vlor1sccor(maxterm_sccor,20,20),
      &    vlor2sccor(maxterm_sccor,20,20),