Modeling Diffusion in Functional Materials: From Density Functional Theory to Artificial Intelligence
Sign Up to like & getrecommendations! Published in 2019 at "Advanced Functional Materials"
DOI: 10.1002/adfm.201900778
Abstract: Diffusion describes the stochastic motion of particles and is often a key factor in determining the functionality of materials. Modeling diffusion of atoms can be very challenging for heterogeneous systems with high energy barriers. In… read more here.
Keywords: theory; density functional; diffusion; modeling diffusion ... See more keywords
Optical Activity of Chiral Nanoscrolls
Sign Up to like & getrecommendations! Published in 2017 at "Advanced Optical Materials"
DOI: 10.1002/adom.201600982
Abstract: A first quantum-mechanical theory of chiral semiconductor nanoscrolls is presented. The theory allows one to analytically calculate the rotatory strengths and dissymmetry factors of optical transitions inside monodisperse ensembles of randomly oriented nanoscrolls, as well… read more here.
Keywords: rotatory strengths; theory; chiral nanoscrolls; activity chiral ... See more keywords
Elevating community-driven socioecological participation and action: A case study with Black youth.
Sign Up to like & getrecommendations! Published in 2023 at "American journal of community psychology"
DOI: 10.1002/ajcp.12679
Abstract: Context is important when considering how racism acts to harm Black youth. Hence, social scientists developed socioecological theories that consider both the individual and the context(s) which shapes them. We used these theories to make… read more here.
Keywords: theory; elevating community; community; make sense ... See more keywords
Sharing the burden: A neutral approach to socioecological theory.
Sign Up to like & getrecommendations! Published in 2018 at "American journal of physical anthropology"
DOI: 10.1002/ajpa.23383
Abstract: OBJECTIVE The socioecological model (SEM) is a popular collection of controversial models purporting to explain mating systems in terms of ecological and social parameters. Despite its guise of objectivity, several of its hypotheses assume Victorian… read more here.
Keywords: mating systems; theory; sharing burden; approach ... See more keywords
Scientists' data reuse behaviors: A multilevel analysis
Sign Up to like & getrecommendations! Published in 2017 at "Journal of the Association for Information Science and Technology"
DOI: 10.1002/asi.23892
Abstract: This study explores the factors that influence the data reuse behaviors of scientists and identifies the generalized patterns that occur in data reuse across various disciplines. This research employed an integrated theoretical framework combining institutional… read more here.
Keywords: reuse; data reuse; multilevel analysis; theory ... See more keywords
JASIS&T special issue on information behavior and information practices theory
Sign Up to like & getrecommendations! Published in 2022 at "Journal of the Association for Information Science and Technology"
DOI: 10.1002/asi.24622
Abstract: Information behavior, and more recently information practices, together are an important area of information science. Significant scholarly work occurs on these topics around the world, which is presented at the major scholarly conferences, including the… read more here.
Keywords: information; theory; information behavior; information practices ... See more keywords
Confidence ellipsoids for ASCA models based on multivariate regression theory
Sign Up to like & getrecommendations! Published in 2018 at "Journal of Chemometrics"
DOI: 10.1002/cem.2990
Abstract: In analysis of variance simultaneous component analysis, permutation testing is the standard way of assessing uncertainty of effect level estimates. This article introduces an analytical solution to the assessment of uncertainty through classical multivariate regression… read more here.
Keywords: ellipsoids asca; theory; confidence ellipsoids; regression theory ... See more keywords
Heterogeneous Nucleation onto Monoatomic Ions: Support for the Kelvin‐Thomson Theory
Sign Up to like & getrecommendations! Published in 2018 at "Chemphyschem"
DOI: 10.1002/cphc.201800698
Abstract: Abstract In this study, the process of heterogeneous nucleation is investigated by coupling a high‐resolution differential mobility analyser (DMA) to an expansion‐type condensation particle counter, the size‐analyzing nuclei counter (SANC). More specifically, we measured the… read more here.
Keywords: seed; theory; nucleation; monoatomic ions ... See more keywords
PtOxCly(OH)z(H2O)n Complexes under Oxidative and Reductive Conditions: Impact of the Level of Theory on Thermodynamic Stabilities
Sign Up to like & getrecommendations! Published in 2022 at "Chemphyschem"
DOI: 10.1002/cphc.202200711
Abstract: Abstract Platinum‐based catalysts with Cl−, OH−, O2− and H2O ligands, are involved in many industrial processes. Their final chemical properties are impacted by calcination and reduction applied during the preparation and activation steps. We investigate… read more here.
Keywords: theory; h2o complexes; complexes oxidative; oxidative reductive ... See more keywords
Punctuating the equilibrium: A lens to understand energy and environmental policy changes
Sign Up to like & getrecommendations! Published in 2019 at "International Journal of Energy Research"
DOI: 10.1002/er.4464
Abstract: Energy policies refer to the suite of governmental actions that address planning, generation, and consumption issues around items such as electricity, transportation, and efficiency. These decisions are sometimes politically contentious, given the complexities and interests… read more here.
Keywords: energy; theory; innovation; energy environmental ... See more keywords
Investigating cognitive neuroscience theories of human intelligence: A connectome‐based predictive modeling approach
Sign Up to like & getrecommendations! Published in 2022 at "Human Brain Mapping"
DOI: 10.1002/hbm.26164
Abstract: Central to modern neuroscientific theories of human intelligence is the notion that general intelligence depends on a primary brain region or network, engaging spatially localized (rather than global) neural representations. Recent findings in network neuroscience,… read more here.
Keywords: theory; network; neuroscience; intelligence ... See more keywords