Spartan

Entered: Wed Oct 07 2015

Operating systems: Linux; MacOS; MS Windows

Type: Binary

Languages:

Distribution: Commercial

Application fields: Chemistry; Modelling; Visualization

Bibliography:

Description:

Spartan Student Edition is a serious molecular modeling package for teaching, and learning, chemistry. Combining Spartan's easy-to-use graphical interface with a targeted set of computational engines, the Student Edition provides fundamental molecular modeling utilities supporting the organic chemistry curriculum.

Spartan'14 offers all features and methods included in the Spartan Essential Edition, and in collaboration with Q-Chem, provides a full range of post-Hartree–Fock methods including density functional, Moller Plesset, thermochemistry recipes (including the new T1 procedure), and an assortment of advanced correlated approaches.

Spartan'14 Parallel Suite provides all the features of Spartan'14, but adds: multi-core parallel processing for ab initio, density functional, RI-MPT, and T1 calculations, the full SMD and SSPD data collections, and the ability to act as a compute server for other Spartan'14 licenses or the iSpartan molecular modeling app. The Spartan'14 Parallel Suite is the dominant version used in academic, government, and commercial research.

References: http://wavefun.com/products/spartan.html

 



Last updated: 07 Oct 2015