Results 231 to 240 of about 922,478 (345)

Predicting Atomic Charges in MOFs by Topological Charge Equilibration

Advanced Functional Materials, EarlyView.
An atomic charge prediction method is presented that is able to accurately reproduce ab‐initio‐derived reference charges for a large number of metal–organic frameworks. Based on a topological charge equilibration scheme, static charges that fulfill overall neutrality are quickly generated.
Babak Farhadi Jahromi, Sumukh Shankar Sharadaprasad, Rochus Schmid   +2 more
wiley   +1 more source

Enhancing groundwater quality assessment in coastal area: A hybrid modeling approach. [PDF]

Heliyon
Uddin MG, Rana MMSP, Diganta MTM, Bamal A, Sajib AM, Abioui M, Shaibur MR, Ashekuzzaman SM, Nikoo MR, Rahman A, Moniruzzaman M, Olbert AI.   +11 more
europepmc   +1 more source

Nonlinear coastal wave prediction with a hybrid approach using phase-resolving models and machine learning

Weizhi Wang, Konstantinos Christakos, Hans Bihs   +2 more
openalex   +1 more source

A Programmable Semiconductor Containing Active Molecular Photoswitches Located in the Crystal's Volume Phase

Advanced Functional Materials, EarlyView.
A novel approach for the design of functional semiconductors is presented, which utilizes the excellent optoelectronic properties of layered hybrid perovskites and the possibility to introduce a molecular photoswitch as the organic spacer. This concept is successfully demonstrated on a coumarin‐based system with the possibility to change the bandgap ...
Oliver Treske, Yaşar Krysiak, Hans Tornatzky, Markus R. Wagner, Sebastian Polarz   +4 more
wiley   +1 more source

Hybrid modeling of an ultracentrifugation process for separation of full and empty adeno-associated virus particles. [PDF]

Bioprocess Biosyst Eng
De-Luca R, Pupo-Correia M, Feldhofer M, Martins DL, Umprecht A, Shahmohammadi A, Corona D, von Stosch M.   +7 more
europepmc   +1 more source

Towards a Hybrid Vegetation Model

Maha Badri, Philipp Hess, Yunan Lin, Sebastian Bathiany, Maximilian Gelbrecht, Niklas Boers   +5 more
openalex   +1 more source

Stabilization of Miscible Aqueous Phases via Diffusion‐Controlled Multifunctional Nanoparticle‐Ligand Complexation

Advanced Functional Materials, EarlyView.
This study presents a versatile approach to harnessing miscible aqueous domains, enabling liquid‐in‐liquid compartmentalization using a barrier formed in situ rather than bulk immiscibility. The barrier forms upon the complexation of multifunctional nanoparticles and ligands at the contact boundary of aqueous phases.
Seyyed Alireza Hashemi, Mahyar Panahi‐Sarmad, Ahmadreza Ghaffarkhah, Vahid Rad, Masoud Soroush, Thomas P. Russell, Orlando J. Rojas, Mohammad Arjmand   +7 more
wiley   +1 more source

A hybrid modeling framework for generalizable and interpretable predictions of ICU mortality across multiple hospitals. [PDF]

Sci Rep
Samadi ME, Guzman-Maldonado J, Nikulina K, Mirzaieazar H, Sharafutdinov K, Fritsch SJ, Schuppert A.   +6 more
europepmc   +1 more source

Hybrid modeling frameworks of tumor development and treatment. [PDF]

Wiley Interdiscip Rev Syst Biol Med, 2020
Chamseddine IM, Rejniak KA.
europepmc   +1 more source

A Hybrid-High Order method for fracture modelling

Crippa, Alessandra, Coatléven, Julien, Di Pietro, Daniele A., Guy, Nicolas, Soleiman, Yousef   +4 more
openalex   +1 more source