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619. MOLDEN: A Portable Electron Density Program
by Gijs Schaftenaar, CAOS/CAMM Center, Faculty of
Science, University of Nijmegen, P. O. Box 9010, 6500
GL Nijmegen, The Netherlands
MOLDEN is a package for displaying molecular density
from the Ab Initio packages GAMESS* and GAUSSIAN.
MOLDEN reads all the required information from the
GAMESS/GAUSSIAN output file.
MOLDEN is capable of displaying molecular orbitals, the
electron density and the molecular minus atomic
density.Either the spherically averaged atomic
density or the oriented ground state atomic density can
be subtracted for a number of standard basis sets.
MOLDEN supports contour plots, 3-D grid plots with
hidden line removal and a combination of both. It can
write a variety of graphics instructions: Tektronix
4014, HPGL, PostScript, X Windows, HP 2392 and Figure.
For the Silicon Graphics there is a version taking
advantage of the 4D Graphics library.
Lines of Code: 8034
FORTRAN 77, C (VAX, SUN, CONVEX, APOLLO, DEC/Ultrix,
IRIS, CRAY-YMP/Unicos)
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*Referred to here is the European version of GAMESS
maintained by M. F. Guest et al., not to be confused
with the American version maintained by M. W. Schmidt
et al.
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