SOFTWARE: Gaussian 03 for Unix, Macintosh and Linux Revision E.01
Description: Gaussian is a program for computational chemistry.
It uses electronic structure modeling to investigate chemical
phenomena. As noted in "Gaussian 03 User's Reference", it can
predict properties of molecules and reactions, including:
- Molecular energies and structures
- Energies and structures of transition states
- Bond and reaction energies
- Orbitals
- Vibrational frequencies
- Thermochemical properties
- Reaction pathways
- g tensors and other tensors of hyperfine spectra
and many other computations. These computations are useful in the
fields of chemistry, chemical engineering, biochemistry, physics,
materials science, pharmacy, medical areas and others for
research in established and emerging areas of chemical interest.
You can read about the new features and functional changes to
Revision E.01 in the Release Notes. These are also available at
http://www.gaussian.com/g_tech/g03_rel.htm
The Gaussian Unix campuswide license was obtained through a cost
sharing collaboration between the departments of Chemistry and
Molecular & Cellular Biochemistry, the college of Pharmacy and
OIT.
PLATFORM: Intel, HP, AMD, SGI, NEC, IBM, Sun and Apple.
SYSTEM REQUIREMENTS:
Intel IA 32 & AMD Athlon: Pentium III or higher, AMD
Athlon, SuSE Linux 9.3, 10.1-10.3; Red Hat Enterprise
Linux 4 Update 2, SuSE Linux Enterprise 10.
AMD Opteron: SuSE Linux 9.0, 9.3, 10.1-10.3, SuSE Linux
Enterprise 10; Red Hat Enterprise Linux 4 Update 3&4.
Intel IA 64: HP/NEC/SGI: SuSE Enterprise Linux 9; Red Hat
Advanced Server 4 Update 2.
HP ALPHA Tru64: Tru64 5.1B.
HP ALPHA Linux: Red Hat Linux 7.2, SuSE Linux 7.1.
HP PA-RISC2: HP-UX 11.
IBM eServer pSeries (RS6000) Power 4 or Power 5 (64-bit): AIX
5.1, 5.2 or 5.3; SuSE Linux Enterprise Server 10.
SGI R1x000 (64 bit): IRIX 6.5.4 or later.
Sun UltraSparc: Solaris 9/10.
Apple IA32 (32-bit Intel Mac): OS X 10.4.9 and later Tiger
releases. Note that Mac OS X 10.5 Leopard is not supported.
Apple EM64T (64-bit Intel Mac): OS X 10.4.9 and later Tiger
releases. Note that Mac OS X 10.5 Leopard is not supported.
Source Code: For a complete listing of all platform combinations
supported via the source code visit
http://www.gaussian.com/g03_plat.htm
This license does NOT entitle you to produce executables for
Supercomputer platforms.
All versions: 600 MB diskspace, 256 MB RAM. Some problems may
require much more RAM.
ELIGIBILITY: Faculty and staff.
RESTRICTIONS: You may use this software only on OSU-owned
equipment on the main campus. Home use is not allowed. This
software is for use for university-related business. It is for
use while you are affiliated with OSU and it must be left with
your department when leaving OSU.
PURCHASE: There is no fee.
COST WITHOUT SITE LICENSE ARRANGEMENTS: The cost of an academic
license for Gaussian for Unix is $2000 for a single binary
computer platform.
DISTRIBUTION: This software is distributed in OIT Customer
Services, 512 Baker Systems. You will loan out a CD media set for
up to 3 working days for installation.
DOCUMENTATION: Installation instructions are distributed with the
loan set.
DISTRIBUTION QUESTIONS: May be directed to the Support Center at
8help@osu.edu or 688-help.