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- W2114768954 abstract "The Density Matrix Renormalization Group (DMRG) algorithm has been a rising star for the accurate ab initio exploration of Born-Oppenheimer potential energy surfaces in theoretical chemistry. However, owing to its iterative numerical nature, pit falls, that can affect the accuracy of DMRG energies, need to be circumvented. Here, after a brief introduction into this quantum chemical method, we discuss criteria that determine the accuracy of DMRG calculations." @default.
- W2114768954 created "2016-06-24" @default.
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- W2114768954 date "2014-04-30" @default.
- W2114768954 modified "2023-10-16" @default.
- W2114768954 title "Determining Factors for the Accuracy of DMRG in Chemistry" @default.
- W2114768954 cites W3094616800 @default.
- W2114768954 doi "https://doi.org/10.2533/chimia.2014.200" @default.
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