Zobrazeno 1 - 10
of 251
pro vyhledávání: '"Constantin, L. A."'
Autor:
Constantin L. Palm, Lukas Baumhove, Simon Pabst, Ulf Guenther, Malte Book, Onise Chaduneli, Andreas Martens, Friedrich Mellert, Oliver Dewald
Publikováno v:
Frontiers in Cardiovascular Medicine, Vol 11 (2024)
ObjectiveVasoplegic syndrome remains a common complication of cardiac surgery. It has serious implications for the healthcare system and individual patients, as it leads to rising healthcare costs and higher mortality. A better understanding of facto
Externí odkaz:
https://doaj.org/article/02547e6ace2943f2bb6846997437554c
Autor:
Palm, Constantin L.1 (AUTHOR) b.d.westenbrink@umcg.nl, Shalaurova, Irina2 (AUTHOR) shalaui@labcorp.com, Connelly, Margery A.2 (AUTHOR) connem5@labcorp.com, Bakker, Stephan J. L.3 (AUTHOR) s.j.l.bakker@umcg.nl, Westenbrink, Berend Daan1 (AUTHOR), Dullaart, Robin P. F.4 (AUTHOR) dull.fam@12move.nl
Publikováno v:
Journal of Clinical Medicine. Mar2024, Vol. 13 Issue 6, p1541. 14p.
Akademický článek
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Publikováno v:
In Journal of Sound and Vibration 3 February 2023 544
Publikováno v:
J. Phys. Chem. Lett. 9, 4385-4390 (2018)
Kinetic energy (KE) approximations are key elements in orbital-free density functional theory. To date, the use of non-local functionals, possibly employing system dependent parameters, has been considered mandatory in order to obtain satisfactory ac
Externí odkaz:
http://arxiv.org/abs/1802.02889
Publikováno v:
Phys. Rev. B 97, 205137 (2018)
Orbital-Free Density Functional Theory (OF-DFT) promises to describe the electronic structure of very large quantum systems, being its computational cost linear with the system size. However, the OF-DFT accuracy strongly depends on the approximation
Externí odkaz:
http://arxiv.org/abs/1802.02126
Publikováno v:
Phys. Rev. B 95, 115153 (2017)
We investigate a highly-nonlocal generalization of the Lindhard function, given by the jellium-with-gap model. We find a band-gap-dependent gradient expansion of the kinetic energy, which performs noticeably well for large atoms. Using the static lin
Externí odkaz:
http://arxiv.org/abs/1705.06034
Publikováno v:
J. Chem. Phys. 146, 064105 (2017)
The development of semilocal models for the kinetic energy density (KED) is an important topic in density functional theory (DFT). This is especially true for subsystem DFT, where these models are necessary to construct the required non-additive embe
Externí odkaz:
http://arxiv.org/abs/1702.04154
Publikováno v:
In Journal of Sound and Vibration 13 October 2021 510
Publikováno v:
J. Chem. Phys. 145, 084110 (2016)
We introduce a novel non-local ingredient for the construction of exchange density functionals: the reduced Hartree parameter, which is invariant under the uniform scaling of the density and represents the exact exchange enhancement factor for one- a
Externí odkaz:
http://arxiv.org/abs/1608.08809