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New process equilibrium can be evaluated after certain operation parameters change.

Auckland 1010. New Zealand. Website:.

It builds on the idea of connected digital twins based on the World Avatar dynamic knowledge graph to deploy an ecosystem of autonomous software agents to continuously ingest new real-world

This new approach offers significant advantages over the prior implementation that relied on knowledge graph embedding.

A new model parameter data set is obtained by a two step parameter estimation against the median and coefficient of variation of experimental particle size distributions for various flames.

There is a strong need to understand the nature of sub-23 nm particles and to develop measurement techniques to evaluate the feasibility of new regulations for particle number emissions in ... The new technology was validated in chassis dyno tests and on

The paper shows a method for identifying the impact of the properties of the new substitutes.

Moreover, a new method that automatically generates training questions from ontologies is also implemented.

Pericondensed aromatics with different symmetries were calculated with this improved functional providing new scaling relationships for the OBG versus size.

A new model has been developed to describe the size-dependent effects that are responsible for transient particle mass (PM) and particle number (PN) emissions observed during experiments of the active

These tools enable the possibility of interoperability, enabling the representation of more complex systems, inference capabilities, and the synthesis of new knowledge.

The model includes new processes to form seven-member rings via hydrogen-abstraction-acetylene-addition and bay closure reactions on sites containing partially embedded five-member rings.

The results indicate that the physical interaction between fullerene-like polar aromatics and chemi-ions is critically assisting the nucleation and opens a new route to reduce pollution and improve

Quantum Chemistry. Full List of Preprints with a Quantum Chemistry theme. 315:Dan N. Tran,and Markus Kraft, Technical Report 315, c4e-Preprint Series, Cambridge, 2023. 294:and Markus Kraft, Technical Report 294, c4e-Preprint Series, Cambridge, 2022.

CES-64-628-637. A New Model for the Drying of Droplets Containing Suspended Solids. ... Abstract. A new droplet drying model incorporating a population balance to model suspended solids is introduced.

C-48-319-332. New polycyclic aromatic hydrocarbon (PAH) surface processes to improve the model prediction of the composition of combustion-generated PAHs and soot. ... Reference: Carbon 48, 319-332, (2010). Abstract. Two new polycyclic aromatic

CES-64-228-246. A New Model for the Drying of Droplets Containing Suspended Solids After Shell Formation. ... Access options. This paper draws from preprint 59: A New Model for the Drying of Droplets Containing Suspended Solids after Shell Formation.

Engines. Full List of Preprints with a Engines theme. 298:Qiren Zhu, Yichen Zong, Jiawei Lai,Wenming Yang, and Markus Kraft, Technical Report 298, c4e-Preprint Series, Cambridge, 2022. 291:and Markus Kraft, Technical Report 291, c4e-Preprint Series,

SJoSC-28-303-320. The Linear Process Deferment Algorithm: A new technique for solving population balance equations. ... Abstract. In this paper a new stochastic algorithm for the solution of population balance equations is presented.

CES-61-158-166. A new method for calculating the diameters of partially-sintered nanoparticles and its effect on simulated particle properties. ... In this paper a new method for the calculation of the diameter of a partially-sintered particle is

CaF-160-947-958. A new model for silicon nanoparticle synthesis. Authors: William J. ... Access options. This paper draws from preprint 121: A new model for silicon nanoparticle synthesis.

PotCI-30-1301-1308. A new algorithm for the direct simulation of combustion systems and its application to reaction elimination. ... Access options. This paper draws from preprint 17: A New Method for the Automatic Elimination of Reactions from Large

Modelling soot formation in a benchmark ethylene stagnation flame with a new detailed population balance model.

213:and Markus Kraft, Technical Report 213, c4e-Preprint Series, Cambridge, 2018. 212: Modelling Soot Formation in a Benchmark Ethylene Stagnation Flame with a New Detailed Population Balance Model.

JoCP-211-638-658. A new numerical approach for the simulation of the growth of inorganic nanoparticles. ... Access options. This paper draws from preprint 22: A New Numerical Approach for the Simulation of the Growth of Inorganic Nanoparticles.

Numerics. Full List of Preprints with a Numerics theme. 299:Mikhail K. Kovalev, Alexei A. Lapkin, Joel W. Ager, and Markus Kraft, Technical Report 299, c4e-Preprint Series, Cambridge, 2022. 289:and Markus Kraft, Technical Report 289, c4e-Preprint

Quantum Chemistry. Full List of Publications with a Quantum Chemistry theme. Number of publications listed in category: 57. 2023. and Markus Kraft, ACS Omega 8(2), 2462-2475, (2023). On the reactive coagulation of incipient soot nanoparticles.

Full List of the Computational Modelling Group's Presentations. Digital Twin Conference 2024Online, 7th February 2024-9th February 2024. Invited presentation byOrlando, Florida, USA, 5th November 2023-10th November 2023. Presentation byCambridge, UK,

TIJoER-13-1-25. Spark ignition to homogeneous charge compression ignition mode transition study: a new modelling approach. ... Access options. This paper draws from preprint 62: Investigating Cycle to Cycle Variations in an SI Engine Through Experiments

Numerics. Full List of Publications with a Numerics theme. Number of publications listed in category: 91. 2023. and Markus Kraft, Proceedings of the Combustion Institute 39(4), 5647-5655, (2023). Mikhail K. Kovalev, Alexei A. Lapkin, Joel W. Ager,

This has led to the calculation of a new rate for the removal of carbon monoxide (CO) from soot. ... The simulation results show satisfactory agreement with experiment for the new CO removal rate.

Reference: Chemical Engineering Science 65, 713-725, (2010). Abstract. Building on the new droplet drying framework developed by the authors in their previous work Handscomb et al., Chem. ... The new criteria are used in conjunction with the previously

Reference: Journal of Aerosol Science 44, 93-98, (2012). Abstract. The aim of this work is to present a new detailed multivariate population balance model to describe the aerosol synthesis of ... The new model includes a chemical representation of the

Spark ignition to homogeneous charge compression ignition mode transition study: a new modelling approach.

213:and Markus Kraft, Technical Report 213, c4e-Preprint Series, Cambridge, 2018. 212: Modelling Soot Formation in a Benchmark Ethylene Stagnation Flame with a New Detailed Population Balance Model.

Lastly, we use molecular dynamics with a new potential specifically developed for PAH interaction and the combined PAH-PP/KMC-ARS model to show that pyrene dimerisation is unlikely to be

Building on the theoretical work presented here and previous experimental results a new kinetic model is constructed consisting of a TiCl. ... Unlike the previous phenomenological models, this new Eley-Rideal model is under the theoretical limit at all

New particle inception and surface growth steps have been incorporated into the particle model in which particles form and grow by the interaction of Si(OH).

Seminar 2. New stochastic simulation algorithms, and applications in coagulation processes and porous flow simulation.

Modelling soot formation in a benchmark ethylene stagnation flame with a new detailed population balance model.

Totton, A.J. Misquitta, M. Kraft, J. Chem. Theory Comput. 6 (2010) 683] by developing a new transferable electrostatic model for PAH molecules.

Mort. Reference: Powder Technology 197, 196-210, (2010). Abstract. A new multidimensional model for wet granulation is presented, which includes particle coalescence, compaction, reaction, penetration, and breakage.

Sebastian Mosbach. Full List of Preprints co-authored by Sebastian Mosbach. 323:and Markus Kraft, Technical Report 323, c4e-Preprint Series, Cambridge, 2024. 322:Andrew Breeson,and Markus Kraft, Technical Report 322, c4e-Preprint Series, Cambridge,

Thermochemical data and enthalpies of formation are calculated for 141 new species using density functional theory (DFT) and statistical mechanics.

Reference: Proceedings of the Combustion Institute 33, 675-683, (2011). Abstract. In this work we present the new PAH-PP soot model and use a data collaboration approach to determine some

Abstract. This paper presents experimental results and a new computational model that investigate cycle to cycle variations (CCV) in a spark ignition (SI) engine. ... Access options. This paper draws from preprint 62: Investigating Cycle to Cycle

technique to iteratively suggest new experiments with the aim of decreasing the uncertainty in the parameter estimates.

Spark ignition to homogeneous charge compression ignition mode transition study: a new modelling approach.

Jethro Akroyd. Full List of Publications co-authored by Jethro Akroyd. Number of publications listed in category: 113. 2024. Yi-Kai Tsai, Magnus Müller, Karthik Nagarajan,and Markus Kraft, Energy and AI 17, 100376, (2024). and Markus Kraft, Energy

Jethro Akroyd. Full List of Preprints co-authored by Jethro Akroyd. 324:and Markus Kraft, Technical Report 324, c4e-Preprint Series, Cambridge, 2024. 323:and Markus Kraft, Technical Report 323, c4e-Preprint Series, Cambridge, 2024. 322:Andrew Breeson