This is the Windows app named GASCAP whose latest release can be downloaded as GASCAP-v0.6.tar.gz. It can be run online in the free hosting provider OnWorks for workstations.
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- 7. Download Wine from your Linux distributions software repositories. Once installed, you can then double-click the app to run them with Wine. You can also try PlayOnLinux, a fancy interface over Wine that will help you install popular Windows programs and games.
Wine is a way to run Windows software on Linux, but with no Windows required. Wine is an open-source Windows compatibility layer that can run Windows programs directly on any Linux desktop. Essentially, Wine is trying to re-implement enough of Windows from scratch so that it can run all those Windows applications without actually needing Windows.
SCREENSHOTS
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GASCAP
DESCRIPTION
About GASCAP
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GASCAP is designed as a universal program to achieve the adsorption evaluation between any substrates and any adsorbates. The pseudoatom and graph Voronoi diagram method are used to figure out the unequal adsorption sites from any substrates, then the coadsorption structure can be built between substrates and any adsorbates in high-throughput way. The universal machine learning interatomic potentials are used to accelerate the adsorption energy calculations, and the postprocessing toolkits contain the functions of analyzing adsorption energy, calculating work function and charge transfer.
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Install Method
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set environment variable in Linux system:
export PATH=/public/home/yiwc/software/GASCAP/v0.6/GASCAP-v0.6:$PATH
if there is any incompatibility problem, please fix them with:
./codes/fix.sh ## require install ifort compile
This is an application that can also be fetched from https://sourceforge.net/projects/gascap/. It has been hosted in OnWorks in order to be run online in an easiest way from one of our free Operative Systems.
