Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Akrobotu, Prosper D."'
Autor:
Negre, Christian F. A., Lopez-Bezanilla, Alejandro, Zhang, Yu, Akrobotu, Prosper D., Mniszewski, Susan M., Tretiak, Sergei, Dub, Pavel A.
Density matrix electronic structure theory is used in many quantum chemistry methods to "alleviate" the computational cost that arises from directly using wave functions. Although density matrix based methods are computationally more efficient than w
Externí odkaz:
http://arxiv.org/abs/2201.04720
The efficient calculation of the centrality or "hierarchy" of nodes in a network has gained great relevance in recent years due to the generation of large amounts of data. The eigenvector centrality (aka eigencentrality) is quickly becoming a good me
Externí odkaz:
http://arxiv.org/abs/2105.00172
Isomer search or molecule enumeration refers to the problem of finding all the isomers for a given molecule. Many classical search methods have been developed in order to tackle this problem. However, the availability of quantum computing architectur
Externí odkaz:
http://arxiv.org/abs/1908.00542
Autor:
Akrobotu, Prosper D.1,2 (AUTHOR), James, Tamsin E.2 (AUTHOR), Negre, Christian F. A.3 (AUTHOR), Mniszewski, Susan M.2 (AUTHOR) smm@lanl.gov
Publikováno v:
PLoS ONE. 7/14/2022, Vol. 17 Issue 7, p1-18. 18p.
Autor:
Terry, Jason P.1,2,3 (AUTHOR), Akrobotu, Prosper D.4,5 (AUTHOR), Negre, Christian F. A.5 (AUTHOR) cnegre@lanl.gov, Mniszewski, Susan M.6 (AUTHOR) cnegre@lanl.gov
Publikováno v:
PLoS ONE. 1/15/2020, Vol. 15 Issue 1, p1-21. 21p.
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