Zobrazeno 1 - 10
of 228
pro vyhledávání: '"J. van Setten"'
Publikováno v:
Molecules, Vol 28, Iss 9, p 3649 (2023)
The availability of thermochemical properties allows for the prediction of the equilibrium compositions of chemical reactions. The accurate prediction of these can be crucial for the design of new chemical synthesis routes. However, for new processes
Externí odkaz:
https://doaj.org/article/fb105bdd17f6474ba40fe61a40858e2b
Publikováno v:
Frontiers in Chemistry, Vol 9 (2021)
We use the GW100 benchmark set to systematically judge the quality of several perturbation theories against high-level quantum chemistry methods. First of all, we revisit the reference CCSD(T) ionization potentials for this popular benchmark set and
Externí odkaz:
https://doaj.org/article/6ee38502dd2449399d223c0f007faba4
Publikováno v:
Journal of Chemical Information and Modeling. 63:1454-1461
Autor:
Yukio Kaneda, Rachel A. Nye, Esteban A. Marques, Silvia Armini, Annelies Delabie, Michiel J. van Setten, Geoffrey Pourtois
Publikováno v:
The Journal of Physical Chemistry C.
Autor:
Marziogiuseppe Gentile, Marius Gerlach, Robert Richter, Michiel J. van Setten, John S. Petersen, Paul A. W. van der Heide, Fabian Holzmeier
Publikováno v:
Advances in Patterning Materials and Processes XL.
Publikováno v:
Nature Communications, Vol 8, Iss 1, Pp 1-8 (2017)
For monitoring hydrogen partial pressure, optical sensors have a particular safety advantage due to absence of wiring in operation area. Here authors show hysteresis-free, reproducible change in optical transmission in palladium-capped hafnium hydrid
Externí odkaz:
https://doaj.org/article/3af14b60c02a416cad3beb1a9784b916
Autor:
Hendrik F. W. Dekkers, Michiel J. van Setten, Attilio Belmonte, Adrian V. Chasin, Subhali Subhechha, Nouredine Rassoul, Anastasia V. Glushkova, Romain Delhougne, Gouri Sankar Kar
Publikováno v:
2022 ACS Applied Electronic Materials
Autor:
Michiel J. van Setten, Hendrik F. W. Dekkers, Christopher Pashartis, Adrian Chasin, Attilio Belmonte, Romain Delhougne, Gouri S. Kar, Geoffrey Pourtois
Publikováno v:
Materials advances
With decreasing dimensions and increasing complexity, semiconductor devices are getting more difficult to fabricate. In particular the allowed deposition temperature becomes lower. Amorphous materials, which do not require annealing steps, are theref
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a83b9e173e3f2fd5c35e47b3e91f845a
https://lirias.kuleuven.be/handle/20.500.12942/709343
https://lirias.kuleuven.be/handle/20.500.12942/709343
Device engineering guidelines for performance boost in IGZO front gated TFTs based on defect control
Autor:
S. Subhechha, N. Rassoul, A. Belmonte, H. Hody, H. Dekkers, M. J. van Setten, A. Chasin, S.H. Sharifi, K. Banerjee, H. Puliyalil, S. Kundu, M. Pak, D. Tsvetanova, N. Bazzazian, K. Vandersmissen, D. Batuk, J. Geypen, J. Heijlen, R. Delhougne, G. S. Kar
Publikováno v:
2022 International Conference on IC Design and Technology (ICICDT).
Autor:
Laura Galleni, Faegheh S. Sajjadian, Thierry Conard, Daniel Escudero, Geoffrey Pourtois, Michiel J. van Setten
Publikováno v:
The journal of physical chemistry letters. 13(37)
We propose a simple additive approach to simulate X-ray photoelectron spectra (XPS) of macromolecules based on the $GW$ method. Single-shot $GW$ ($G_0W_0$) is a promising technique to compute accurate core-electron binding energies (BEs). However, it