8d44eb9488
Mopac is semiempirical molecular energy calculation program for chemistry and physics. From pkgsrc-wip, original from PR pkg/18046 by Osamu OISHI.
26 lines
869 B
Text
26 lines
869 B
Text
$NetBSD: patch-ac,v 1.1.1.1 2008/03/09 17:52:57 tnn Exp $
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Loosen types (real -> complex) to allow building with f2c.
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--- cdiag.f.orig 1993-04-20 05:38:10.000000000 +0400
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+++ cdiag.f 2008-03-05 21:26:56.000000000 +0300
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@@ -195,8 +195,8 @@
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C
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C TO FIND THE EIGENVALUES AND VECTORS OF A TRI-DIAGONAL
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C HERMITIAN MATRIX.
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- REAL VALUE(*),W(*),PCK(2),ONE,ZERO,VEC(*)
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- COMPLEX A(*),B(*),DN,UPCK
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+ REAL VALUE(*),PCK(2),ONE,ZERO
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+ COMPLEX A(*),B(*),DN,UPCK,W(*),VEC(*)
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EQUIVALENCE (PCK(1),UPCK)
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C WE TREAT VEC AS IF IT IS DEFINED AS COMPLEX VEC(IV,N)
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C IN THE CALLING PROGRAM.
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@@ -395,7 +395,7 @@
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90 RETURN
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END
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SUBROUTINE ME08B (A,Q,B,N,IA)
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- REAL A(IA,*),Q(2,*),B(IA,*)
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+ COMPLEX A(IA,*),Q(2,*),B(IA,*)
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DO 10 I=1,N
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A(1,I)=A(1,I) -Q(1,1)*B(1,I)+Q(2,1)*B(2,I)
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1 -Q(1,I)*B(1,1)+Q(2,I)*B(2,1)
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