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[[File:IRASPA-logo.png| | |||
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'''iRASPA''' <ref>[https://doi.org/10.1080/08927022.2018.1426855 David Dubbeldam, Sofía Calero & Thijs J.H. Vlugt "iRASPA: GPU-accelerated visualization software for materials scientists", Molecular Simulation (advance article)]</ref> | '''iRASPA''' <ref>[https://doi.org/10.1080/08927022.2018.1426855 David Dubbeldam, Sofía Calero & Thijs J.H. Vlugt "iRASPA: GPU-accelerated visualization software for materials scientists", Molecular Simulation (advance article)]</ref> | ||
is a GPU-accelated visualization package (with editing capabilities) aimed at material science. Examples of materials are metals, metal-oxides, ceramics, biomaterials, zeolites, clays, and metal-organic frameworks. iRASPA is exclusively for macOS and as such can leverage the latest visualization technologies with high performance. iRASPA extensively utilizes GPU computing. For example, void-fractions and surface areas can be computed in a fraction of a second for small/medium structures and in a few seconds for very large unit cells. It can handle large structures (hundreds of thousands of atoms), including ambient occlusion, with high frame rates. | is a GPU-accelated visualization package (with editing capabilities) aimed at material science. Examples of materials are metals, metal-oxides, ceramics, biomaterials, zeolites, clays, and metal-organic frameworks. iRASPA is exclusively for macOS and as such can leverage the latest visualization technologies with high performance. iRASPA extensively utilizes GPU computing. For example, void-fractions and surface areas can be computed in a fraction of a second for small/medium structures and in a few seconds for very large unit cells. It can handle large structures (hundreds of thousands of atoms), including ambient occlusion, with high frame rates. | ||
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* structure creation and editing, | * structure creation and editing, | ||
* creating high-quality pictures and movies, | * creating high-quality pictures and movies, | ||
* | * Ambient_occlusion|ambient occlusion and High-dynamic-range_rendering|high-dynamic range rendering, | ||
* collage of structures, | * collage of structures, | ||
* (transparent) adsorption surfaces, | * (transparent) adsorption surfaces, | ||
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iRASPA 1.1 screen shot. | iRASPA 1.1 screen shot. | ||
==External links== | ==External links== | ||
*[http://www.iraspa.org/ iRASPA web site] | *[http://www.iraspa.org/ iRASPA web site] | ||
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*[https://itunes.apple.com/us/app/iraspa/id1032957936?ls=1&mt=12 iRASPA is freely available from the macOS appstore] | *[https://itunes.apple.com/us/app/iraspa/id1032957936?ls=1&mt=12 iRASPA is freely available from the macOS appstore] | ||
*[http://gregchung.github.io/CoRE-MOFs/ Computation-Ready, Experimental Metal-Organic Frameworks Database] | *[http://gregchung.github.io/CoRE-MOFs/ Computation-Ready, Experimental Metal-Organic Frameworks Database] | ||
==References== | |||
<references/> | |||
[[Category: Materials modelling and computer simulation codes]] | [[Category: Materials modelling and computer simulation codes]] |