Search results for "rajapinnat"

Agents driven smart sensors

2017

Any physical area (like schools, home, hospitals etc.) that uses either mobile devices, sensors, embedded systems or computers to gather information from the users and the environment and eventually, adapt according to the new information gained. [1] Smart spaces compromises of heterogeneous hardware which often leads to the issues of interoperability. One way of reducing the heterogeneity between the sensors is to introduce the semantic interface as sensors default interface. Semantic Web provides a common interface and for-mat for data representation so that one can decrease the heterogeneity of data and increase data reusability. [2] With the Smart Spaces, it is important to use only the…

Accelerated transport and growth with symmetrized dynamics

2013

In this paper we consider a model of accelerated dynamics with the rules modified from those of the recently proposed [Dong et al., Phys. Rev. Lett. 109, 130602 (2012)] accelerated exclusion process (AEP) such that particle-vacancy symmetry is restored to facilitate a mapping to a solid-on-solid growth model in $1+1$ dimensions. In addition to kicking a particle ahead of the moving particle, as in the AEP, in our model another particle from behind is drawn, provided it is within the ``distance of interaction'' denoted by ${\ensuremath{\ell}}_{\mathrm{max}}$. We call our model the doubly accelerated exclusion process (DAEP). We observe accelerated transport and interface growth and widening …

Vuorovaikuttavien satunnaiskävelijöiden autokorrelaatiot ja rajapintojen leveys

2008

Unraveling the Role of the Rh–ZrO2 Interface in the Water–Gas-Shift Reaction via a First-Principles Microkinetic Study

2018

The industrially important water–gas-shift (WGS) reaction is a complex network of competing elementary reactions in which the catalyst is a multicomponent system consisting of distinct domains. Herein, we have combined density functional theory calculations with microkinetic modeling to explore the active phase, kinetics, and reaction mechanism of the WGS over the Rh–ZrO2 interface. We have explicitly considered the support and metal and their interface and find that the Rh–ZrO2 interface is far more active toward WGS than Rh(111) facets, which are susceptible to CO poisoning. CO2 forming on the zirconia support rapidly transforms into formate. These findings demonstrate the central role of…

Novel Methodologies to Model Charge Transport in Metal-Air Batteries

2018

Surface Coordination of Multiple Ligands Endows N‐Heterocyclic Carbene‐Stabilized Gold Nanoclusters with High Robustness and Surface Reactivity

2020

Deciphering the molecular pictures of the multi-component and non-periodic organic-inorganic interlayer is a grand technical challenge. Here we show that the atomic arrangement of hybrid surface ligands on metal nanoparticles can be precisely quantified through comprehensive characterization of a novel gold cluster, Au 44 ( i Pr 2 -bimy) 9 (PA) 6 Br 8 , which features three types of ligands, namely, carbene (1,3-diisopropylbenzimidazolin-2-ylidene, i Pr 2 -bimy), alkynyl (phenylacetylide, PA), and halide (Br), respectively. The delicately balanced stereochemical effects and bonding capabilities of the three ligands give rise to peculiar geometrical and electronic structures. Remarkably, des…

Unraveling the prominent role of the Rh/ZrO2-interface in the water-gas shift reaction via a first principles microkinetic study

2018

The industrially important water–gas-shift (WGS) reaction is a complex network of competing elementary reactions in which the catalyst is a multicomponent system consisting of distinct domains. Herein, we have combined density functional theory calculations with microkinetic modeling to explore the active phase, kinetics, and reaction mechanism of the WGS over the Rh–ZrO2 interface. We have explicitly considered the support and metal and their interface and find that the Rh–ZrO2 interface is far more active toward WGS than Rh(111) facets, which are susceptible to CO poisoning. CO2 forming on the zirconia support rapidly transforms into formate. These findings demonstrate the central role of…

Escaping scaling relationships for water dissociation at interfacial sites of zirconia-supported Rh and Pt clusters

2019

<p>Water dissociation is an important reaction involved in many industrial processes and a good model reaction for probing the activity of catalytic sites. In this computational study, the dissociation of water at interfacial sites of globally optimized ZrO2 sup- ported Pt and Rh clusters is investigated under the framework of density functional theory. Our findings demonstrate that the perimeter sites of these small clusters can activate water, but the dissociation behavior varies considerably between sites. It is shown that the studied clusters break scaling relationships for water dissociation, suggesting these catalysts may achieve activities beyond the maximum imposed by such rel…

Enhanced Surface Ligands Reactivity of Metal Clusters by Bulky Ligands for Controlling Optical and Chiral Properties.

2021

Surface ligands play critical roles in determining the surface properties of metal clusters. However, modulating the properties and controlling the surface structure of clusters through surface‐capping agent displacement remain a challenge. In this work, a silver cluster, [Ag 14 (SPh(CF 3 ) 2 ) 12 (PPh 3 ) 4 (DMF) 4 ] ( Ag 14 ‐DMF , where HSPh(CF 3 ) 2 is 3,5‐bis(trifluoromethyl)benzenethiol, PPh 3 is triphenylphosphine and DMF is N,N‐Dimethylformamide), with weakly coordinated DMF ligands on the surface silver sites, was synthesized by using a mixed ligands strategy (bulky thiolates, phosphines and small solvents). The as‐prepared Ag 14 ‐DMF is a racemic mixture of chiral molecules. Owing …

Pilvipalvelun ja teollisuuden ohjausjärjestelmän välisen rajapinnan toteutus

2017

Teollisuuden ohjaus- ja valvontajärjestelmät ovat toimineet pitkään tehdasprosessien sisäisinä itsenäisinä ja suljettuina järjestelminä. Nykypäivän trendi on, että näistä automaatiojärjestelmistä (Process Automation System) ja niiden ohjaamista prosesseista haluttaisiin kerätä tietoa keskitetysti verkon yli. Aikaisemmin tämä tiedonkeruu on tapahtunut järjestelmän sisällä samassa toimitilassa. Tiedonkeruun toteutukseen tarvittaisiin rajapinta (Interface), joka toimisi pilvipalvelun (Cloud service) ja teollisuudenjärjestelmän välillä. Rajapinta mahdollistaisi monenlaisten tietojen keruun teollisuudenjärjestelmistä keskitetysti pilvipalveluun. Tulevaisuudessa ja jopa nykypäivänä tiedon keräämi…