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221. PCILO: CDC 6600 Version
by P. Claverie, J. P. Daudey, S. Diner, Cl. Giessner-
Prettre, M. Gilbert, J. Langlet, J. P. Malrieu, U.
Pincelli, and B. Pullman, Laboratoire de Chimie
Quantique, Institut de Biologie Physicochimique, 13 rue
P. et M. Curie, Paris 53, France
Modified by R. W. Counts, QCPE
This is the same program as QCPE 220. The only changes
which have been made to the program are those required
by the differences between CDC 6600 FORTRAN and IBM
FORTRAN. Certain other differences exist, such as none
of the variables are double precision in the CDC 6600
version, and an adjustment in the arrangement of COMMON
to accommodate the CDC 6600 has been made.
This program required 73,728 decimal words of storage
to compile and execute. This represents 220,000 octal
words and is the maximum amount of core which was
available at QCPE.
The program was tested using the ETHANE input shown in
the PCILO documentation and yielded results in
excellent agreement with those given for the IBM
version.
FORTRAN IV (CDC 6600)
Lines of Code: 2415
Recommended Citation: B. Pullman et al., QCPE 11, 221
(1972).
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