Gaussian 16 Rev C.01 Linux64 / 09W 9.5 Rev D.01 Windows

Published on: 2020-05-15 10:30:23

Categories: 12

Description

Gaussian software for professionals chemistry computational is. The first version of the program year 1970 was released, but over time to one of the famous in the field of chemistry, computational converter patrol. This program by Professor John Pople and research team in university, Mellon was made. Professor Pople, and his disciples, with the use of the capabilities of this software good research in chemistry, quantum and other branches did, which represents the practical application of this product. Gaussian, the ability of Modeling the structure of the electronic in … version of Windows this software has the suffix w is (like 09w) and also for computers, a Mac based on power pc software extension m will be . A version 32-bit single CPU as well as the version of the reflections, at the discretion of The Examiners, which has the extension IM is, for example, 09IM. Version Windows Gaussian the possibility of running as a single processor or multiple processor units.

Features and software features Gaussian:

Has a large number of algorithms is an important and basic
Modeling a variety of topics related to chemistry, computational
Optimization, geometry and modeling chemical reactions
Vibration analysis
To work profile of the different molecular
Calculations ONIOM
Analysis of the states of arousal
Automatic optimization of the vibrations or energy point
Swap the convenient isotopes of the elements and temperature change and profile push them
Simple definition Fragment and specifications molecular they
Automatic optimization of the structures of the transitional
Selection and sort States the normal interest during the calculations, the frequency, and also save and read the toggled
Recover data from Multiple File Check-Point for calculations
And …

System requirements

32-bit Version

Licenses for the 32-bit version of Gaussian 09W are available for both single computers and for an unlimited number of computers at a licensed site.

Recommended Minimum System Requirements

As is the case with all 32-bit Fortran applications, the 32-bit version of Gaussian 09W is limited to accessing at most 2 GB of RAM and 16 GB of disk regardless of how much memory is available on the system. The 32-bit multiprocessor version of G09W is limited to 4 processors (or cores). The 32-bit version of G09W will run on 64-bit computer systems, albeit with the disk and memory limitations inherent to 32-bit applications.

Processor: Intel Pentium 4, AMD Athlon, and later.
Operating System:

requirements for G09W alone: Microsoft Windows XP, Windows 7, Windows 8, 8.1, Windows 10, Windows Server 2012 R2.
requirements for G09W Cluster/Network Parallel versions: Microsoft Windows XP.

Memory (RAM): 1 GB
Disk: 1.7 GB (G09W storage); and 500 MB or more (scratch space)
Other: CD-ROM drive; Mouse

64-bit Version

Single computer licenses as well as site-wide licenses are available for the 64-bit version of Gaussian 09W.

Recommended Minimum System Requirements

The 64-bit version of G09W is not limited in the number of processors (or cores) that can be accessed for shared memory parallel calculations. It does not have the 32-bit addressing limitations that the 32-bit G09W version has, so for all practical purposes, the 64-bit version of G09W can access an unlimited amount of memory and disk space.

Processor: AMD64, or Intel64 (EM64T) system running supported 64-bit Windows version.
Operating System:

64-bit, Microsoft Windows 7 Home Premium, Professional, Ultimate Windows 8, 8.1, Windows 10, Windows Server 2012 R2.

Memory (RAM): >2 GB
Disk: 1.5 GB (G09W storage); and 500 MB or more (scratch space)
Other: CD-ROM drive; Mouse

Images

Installation guide

Version Windows and GaussView serial register are. Version linux full.

Installation procedure version 16 Linux:

Installation :
mkdir -p $ HOME / opt / gaussian / scr
export g16root = $ HOME / opt / gaussian
tar xvjf G16-A03-AVX2.tbz -C $ g16root
export GAUSS_EXEDIR = $ g16root / g16
export GAUSS_SCRDIR = $ g16root / scr
chmod -R $ 700 GAUSS_EXEDIR
cd $ GAUSS_EXEDIR
./bsd/install
Run the calculation :
$ GAUSS_EXEDIR / g16 example.inp