Roberto Di Remigio edited untitled.md  about 8 years ago

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results for lower level calculations.  2. Low scaling (or better parallelization options) + (perhaps?) controllable error of stochastic methods  are the key advantages. **Find relevant literature on both!**  \cite{Booth_2014}  * The creation of the appropriate software toolbox with good scalability.  1. The toolbox will be freely available under the appropriate open source license (GPL most likely!) 

The methods leverages the stochastic sampling strategies of the FCI wave function in a discrete Fock space first proposed by Alavi _et al._\cite{Booth_2009}  * Linked Coupled Cluster Monte Carlo: the stochastic algorithm for the solution of the CC equations in the linked (term-by-term size-extensive) form \cite{Franklin_2016}  * Initiator approximation: the same group proposes the initiator approximation for the CCMC algorithm \cite{Spencer_2016}  * Stochastic Møller-Plesset \cite{Thom_2007}  Problems to address: