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Latest version of Advanced Simulation Library is 0.1.7 and it was released on. It enables users to write customized numerical solvers in C and deploy them on a. Since the development of CASTEP, the cost of performing calculations has become so low that tens of thousands, or even millions, of calculations can be performed.

A potential area of future growth for CASTEP is in the pharmaceutical industry, where it is starting to be used in combination with solid-state NMR to detect impurities in drug molecules.

Commercial sales and a recently launched low cost European academic release are handled by Accelrys. “In contrast to the code re-writes in the ASCI programme in the United States, in which each re-write cost $25 million, CASTEP was re-written by six people in their spare time at a fraction of that cost.” The code is free for any UK-based academics to use, and more than 750 academic papers based on CASTEP calculations were published in 2012. In 2012, more than 750 academic papers were published based on CASTEP calculations Professor Payne attributes the product’s success to a continuous process of development and improvement which included a complete re-write of the code that was done by the CASTEP Developers Group between 20.

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