1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
|
*** src/Makefile.orig Sat May 25 04:04:15 1991
--- src/Makefile Thu Nov 12 11:20:18 1998
***************
*** 27,37 ****
# level and when it is working, increase the optimization level. So far
# optimization has never caused problems with this program.
#
! # SGI 4D series flags
#
f77 = f77
! FFLAGS = -w0 -O4 -G 64
! LFLAGS = -lfastm -lfpe -s
#
# SUN Sparc series flags version 1.3 or later compiler
#
--- 27,43 ----
# level and when it is working, increase the optimization level. So far
# optimization has never caused problems with this program.
#
! # FreeBSD
#
f77 = f77
! FFLAGS = -O3 -Wall
! LFLAGS =
! #
! # SGI 4D series flags
! #
! #f77 = f77
! #FFLAGS = -w0 -O4 -G 64
! #LFLAGS = -lfastm -lfpe -s
#
# SUN Sparc series flags version 1.3 or later compiler
#
***************
*** 60,66 ****
# Place your G88/G90 util library definition here if you wish to
# compile chk2psi
#
! G90LIB = /usr/people/frisch/g90/libg90.a
#
# define the directory where the executables will reside
# usually /usr/local/bin or ~/bin to put it in your own directory
--- 66,72 ----
# Place your G88/G90 util library definition here if you wish to
# compile chk2psi
#
! #G90LIB = /usr/people/frisch/g90/libg90.a
#
# define the directory where the executables will reside
# usually /usr/local/bin or ~/bin to put it in your own directory
***************
*** 84,96 ****
#######################################################################
#
! all: PSI1 PSICON PSI2CT PSI2HP PSI2PS PREPLOT chk2psi $(EXTRAS)
#
# Install in the executable directory - may need to be superuser
# depending on where you decide to put it (/usr/local/bin for instance)
#
! install: PSI1 PSICON PSI2CT PSI2HP PSI2PS PREPLOT chk2psi $(EXTRAS)
mv PSI1 $(BIN)
chmod +rx $(BIN)/PSI1
mv PSICON $(BIN)
--- 90,104 ----
#######################################################################
#
! # all: PSI1 PSICON PSI2CT PSI2HP PSI2PS PREPLOT chk2psi $(EXTRAS)
! all: PSI1 PSICON PSI2CT PSI2HP PSI2PS PREPLOT $(EXTRAS)
#
# Install in the executable directory - may need to be superuser
# depending on where you decide to put it (/usr/local/bin for instance)
#
! #install: PSI1 PSICON PSI2CT PSI2HP PSI2PS PREPLOT chk2psi $(EXTRAS)
! install: PSI1 PSICON PSI2CT PSI2HP PSI2PS PREPLOT $(EXTRAS)
mv PSI1 $(BIN)
chmod +rx $(BIN)/PSI1
mv PSICON $(BIN)
***************
*** 99,106 ****
chmod +rx $(BIN)/PREPLOT
mv PSI2* $(BIN)
chmod +rx $(BIN)/PSI2*
! mv chk2psi $(BIN)
! chmod +rx $(BIN)/chk2psi
#
# This is the Density matrix generation program (PSI1/88)
--- 107,115 ----
chmod +rx $(BIN)/PREPLOT
mv PSI2* $(BIN)
chmod +rx $(BIN)/PSI2*
!
! # mv chk2psi $(BIN)
! # chmod +rx $(BIN)/chk2psi
#
# This is the Density matrix generation program (PSI1/88)
***************
*** 164,169 ****
# Clean up when done
#
clean :
! touch a.out foo.o core foo.u foo.f17 foo.22
rm -f a.out *.o core *.u *.f17 *.f2*
--- 173,178 ----
# Clean up when done
#
clean :
! touch a.out foo.o core foo.u foo.f17 foo.22
rm -f a.out *.o core *.u *.f17 *.f2*
|