GaussView SOFTWARE
Introduction GaussView is a graphical user interface designed to help you prepare input for submission to Gaussian and to examine graphically the output that Gaussian produces. GaussView is not integrated with the computational module of Gaussian, but rather is a front-end/back-end processor to aid in the use of Gaussian. GaussView provides three main benefits to Gaussian users. First, through its advanced visualization facility, GaussView allows you to rapidly sketch in even very large molecules, then rotate, translate and zoom in on these molecules through simple mouse operations. It can also import standard molecule file formats such as PDB files. Secondly, GaussView makes it easy to set up many types of Gaussian calculations. It makes preparing complex input easy for both routine job types and advanced methods like ONIOM, STQN transition structure optimizations (i.e., Opt=QST2/QST3), CASSCF calculations, periodic boundary conditions (PBC) calculations, and many more. In SERC, you cannot use GaussView to launch jobs because Gaussian is disabled for normal users. If you want to run jobs in Gaussian 09 and Gaussview, you can contact System Administrator(109) to enable your account for Gaussian. Lastly, you can define default and named calculation templates known as schemes to speed up the job setup process. Finally, GaussView lets you examine the results of Gaussian calculations using a variety of graphical techniques. Vendor : Gaussian Inc. Supplier : Gaussian Inc. License Type : Platform architecture specific
node-locked, site-wide binary license for Indian Institute
of Science.
Availability of Gaussview 5.0.9 at SERC : This software is available on all sunlx and hplx machines on the bay area of SERC Gaussview software can be invoked by setting the path as follows, Software documentation:
Report Problems to: For any problems with respect to Gaussview software, contact helpdesk@serc.iisc.ernet.in or System Administrators at Room no. 109 .
|
