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SCIGRESS - Hardware and Software Requirements

SCIGRESS for Windows

  • Minimum hardware configuration: Intel Pentium 4 2.0 GHz or higher; 1 GB RAM or more; 250 MB HDD space or more; OpenGL accelerated graphics hardware.

  • Operating systems: Windows XP (service pack 2), VISTA, Windows 7, 8 and 10.

SCIGRESS for Linux

  • Minimum hardware configuration: Intel Pentium 4 2.0 GHz or higher; 1 GB RAM or more; 250 MB HDD space or more; OpenGL accelerated graphics hardware.

  • Operating systems: Linux (Ubuntu, OpenSUSE, Debian, Centos) 32&64 bit.

SCIGRESS for MacOS

  • Operating systems: OS X 10.9.

SCIGRESS Server

  • Minimum hardware configuration: Intel Core2 Duo 3.0 GHz or higher, 4GB RAM or more; 1GB HDD space or more .

  • Software requirements:

    • Operating system: Linux RedHat/CentOS v. 4 or 5 (both are supported, 32&64 bit).

    • Additional software: JDK6, Open Message Queue (4.2 or 4.3), Tomcat v5.5.25, Axis2 webservice engine, MPICH 1.2.7p1.

    • Job schedulers: Oracle Grid Engine.

Parallel Engines in SCIGRESS:

Engine SCIGRESS Windows SCIGRESS Linux SCIGRESS Mac SCIGRESS Server
MO-G No Yes No Yes
DGauss Yes Yes1 Yes1 Yes1
LocalSCF Yes Yes Yes Yes
MD-ME No Yes No Yes
  1. Some computational algorithms are parallelized

Comments

ADF, ADF BAND, CONFLEX7, GAMESS, Gaussian, LAMMPS, MOPAC 2012, and PHASE are not included in the package.

SCIGRESS works with Gaussian 03W revision B.03 or higher.

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