Zobrazeno 1 - 10
of 51
pro vyhledávání: '"Curtis L. Janssen"'
Publikováno v:
ACM SIGMETRICS Performance Evaluation Review. 38:4-8
A key problem facing application developers is that they are expected to utilize extreme levels of parallelism soon after delivery of future leadership class machines, but developing applications capable of exposing sufficient concurrency is a time c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4929f9a1d5a002b9ecef8a317cb2c977
https://doi.org/10.1145/1964218.1964220
https://doi.org/10.1145/1964218.1964220
Autor:
Joseph P. Kenny, Scott Cranford, Curtis L. Janssen, Helgi Adalsteinsson, Ali Pinar, David A. Evensky, Jackson R. Mayo
Publikováno v:
International Journal of Distributed Systems and Technologies. 1:57-73
Efficient design of hardware and software for large-scale parallel execution requires detailed understanding of the interactions between the application, computer, and network. The authors have developed a macro-scale simulator (SST/macro) that permi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::01a9fb291e326a84553d52b430eeab8a
https://doi.org/10.4018/jdst.2010040104
https://doi.org/10.4018/jdst.2010040104
Publikováno v:
Scientific Programming, Vol 16, Iss 4, Pp 287-296 (2008)
Cutting-edge scientific computing software is complex, increasingly involving the coupling of multiple packages to combine advanced algorithms or simulations at multiple physical scales. Component-based software engineering (CBSE) has been advanced a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bca438dd1fc5db6fcc6bdf5cbe368149
https://doi.org/10.1155/2008/486876
https://doi.org/10.1155/2008/486876
Publikováno v:
Journal of Computational Chemistry. 29:562-577
Sharing low-level functionality between software packages enables more rapid development of new capabilities and reduces the duplication of work among development groups. Using the component approach advocated by the Common Component Architecture For
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::efeb2295b2c5cf23d7ab6861a0003ec0
https://doi.org/10.1002/jcc.20815
https://doi.org/10.1002/jcc.20815
Autor:
Rollin A. King, Justin T. Fermann, Edward F. Valeev, Curtis L. Janssen, Joseph P. Kenny, Matthew L. Leininger, T. Daniel Crawford, Edward T. Seidl, Wesley D. Allen, Shawn T. Brown, C. David Sherrill
Publikováno v:
Journal of Computational Chemistry. 28:1610-1616
PSI3 is a program system and development platform for ab initio molecular electronic structure computations. The package includes mature programming interfaces for parsing user input, accessing commonly used data such as basis-set information or mole
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0758207eb7380d7e90ff164e351558fd
https://doi.org/10.1002/jcc.20573
https://doi.org/10.1002/jcc.20573
Autor:
Ida M. B. Nielsen, Curtis L. Janssen
Publikováno v:
Journal of chemical theory and computation. 3(1)
A massively parallel algorithm is presented for computation of energies with local second-order Moller-Plesset (LMP2) perturbation theory. Both the storage requirement and the computational time scale linearly with the molecular size. The parallel al
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a6de0b3338ee9bd6e1686ac390e368ec
https://pubmed.ncbi.nlm.nih.gov/26627153
https://pubmed.ncbi.nlm.nih.gov/26627153
Autor:
Vidhya Gurumoorthi, Ida M. B. Nielsen, Manojkumar Krishnan, Curtis L. Janssen, Theresa L. Windus, Joseph P. Kenny, Edward F. Valeev
Publikováno v:
Journal of Physics: Conference Series. 46:220-228
Steady performance gains in computing power, as well as improvements in Scientific computing algorithms, are making possible the study of coupled physical phenomena of great extent and complexity. The software required for such studies is also very c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::00d365e32959a88e805236ab1ce56255
https://doi.org/10.1088/1742-6596/46/1/031
https://doi.org/10.1088/1742-6596/46/1/031
Autor:
Dennis Gannon, Benjamin A. Allan, David E. Bernholdt, Curtis L. Janssen, Manojkumar Krishnan, Craig E. Rasmussen, Tamara L. Dahlgren, Steven G. Parker, Yuri Alexeev, Gary Kumfert, Theresa L. Windus, Robert C. Armstrong, Lois Curfman McInnes, Jarek Nieplocha, James Arthur Kohl, Joseph P. Kenny
Publikováno v:
Journal of Physics: Conference Series. 16:536-540
Recent advances in both computational hardware and multidisciplinary science have given rise to an unprecedented level of complexity in scientific simulation software. This paper describes an ongoing grass roots effort aimed at addressing complexity
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1a8e985697d53c04a97fa60d43d39f4d
https://doi.org/10.1088/1742-6596/16/1/073
https://doi.org/10.1088/1742-6596/16/1/073
Publikováno v:
The Journal of Physical Chemistry A. 106:3850-3854
The face-to-face and face-to-back stacked uracil dimers have been investigated by second-order Moller−Plesset (MP2) perturbation theory and by the coupled-cluster singles and doubles method augmented with a perturbative contribution from connected
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::73d6b8f8e6908733ec0d45161f12652e
https://doi.org/10.1021/jp013866f
https://doi.org/10.1021/jp013866f
Publikováno v:
Chemical Physics Letters. 352:26-32
The 2 P ground electronic state of the sulfur fluoride radical has been characterized by high-level ab initio methods, employing the CCSD(T) method with large, augmented correlation-consistent basis sets including aug-cc-pVTZ, augcc-pwCVTZ, and aug-c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::481065fe14448066468748a2269c052a
https://doi.org/10.1016/s0009-2614(01)01382-3
https://doi.org/10.1016/s0009-2614(01)01382-3