Next Issue
Volume 5, March
Previous Issue
Volume 4, September
 
 

J, Volume 4, Issue 4 (December 2021) – 22 articles

  • Issues are regarded as officially published after their release is announced to the table of contents alert mailing list.
  • You may sign up for e-mail alerts to receive table of contents of newly released issues.
  • PDF is the official format for papers published in both, html and pdf forms. To view the papers in pdf format, click on the "PDF Full-text" link, and use the free Adobe Reader to open them.
Order results
Result details
Section
Select all
Export citation of selected articles as:
18 pages, 453 KiB  
Article
Argumentation and Defeasible Reasoning in the Law
by Marco Billi, Roberta Calegari, Giuseppe Contissa, Francesca Lagioia, Giuseppe Pisano, Galileo Sartor and Giovanni Sartor
J 2021, 4(4), 897-914; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040061 - 18 Dec 2021
Cited by 3 | Viewed by 3161
Abstract
Different formalisms for defeasible reasoning have been used to represent knowledge and reason in the legal field. In this work, we provide an overview of the following logic-based approaches to defeasible reasoning: defeasible logic, Answer Set Programming, ABA+, ASPIC+, and DeLP. We compare [...] Read more.
Different formalisms for defeasible reasoning have been used to represent knowledge and reason in the legal field. In this work, we provide an overview of the following logic-based approaches to defeasible reasoning: defeasible logic, Answer Set Programming, ABA+, ASPIC+, and DeLP. We compare features of these approaches under three perspectives: the logical model (knowledge representation), the method (computational mechanisms), and the technology (available software resources). On top of that, two real examples in the legal domain are designed and implemented in ASPIC+ to showcase the benefit of an argumentation approach in real-world domains. The CrossJustice and Interlex projects are taken as a testbed, and experiments are conducted with the Arg2P technology. Full article
(This article belongs to the Special Issue The Impact of Artificial Intelligence on Law)
Show Figures

Figure 1

16 pages, 448 KiB  
Article
Computational Electromagnetics: A Miscellany
by Igor Tsukerman
J 2021, 4(4), 881-896; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040060 - 15 Dec 2021
Cited by 1 | Viewed by 2452
Abstract
The paper presents a miscellany of unorthodox and, in some cases, paradoxical or controversial items related to computational and applied electromagnetics. The topics include a definition of the magnetic source field via a line integral, losses in electric power transmission vs. losses in [...] Read more.
The paper presents a miscellany of unorthodox and, in some cases, paradoxical or controversial items related to computational and applied electromagnetics. The topics include a definition of the magnetic source field via a line integral, losses in electric power transmission vs. losses in photonics, homogenization of periodic electromagnetic structures, spurious modes, models of plasmonic media, and more. It is hoped that this assortment of subjects will be of interest to a broad audience of scientists and engineers. Full article
(This article belongs to the Special Issue Computation of Electromagnetic Fields)
Show Figures

Figure 1

16 pages, 7003 KiB  
Article
Coupling of External Electric Circuits with Computational Domains
by Riccardo Scorretti
J 2021, 4(4), 865-880; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040059 - 14 Dec 2021
Cited by 2 | Viewed by 2110
Abstract
Coupling of electrical circuits with 2D and 3D computational domains is very important for practical applications. To this aim, the notions of “electrical current” and “voltage” must be defined precisely and linked with local quantities (i.e., fields and potentials) in the computational domain. [...] Read more.
Coupling of electrical circuits with 2D and 3D computational domains is very important for practical applications. To this aim, the notions of “electrical current” and “voltage” must be defined precisely and linked with local quantities (i.e., fields and potentials) in the computational domain. Apart from the static case, the definition of voltage is more complex than it may appear at a first glance, and it is usually tainted by unspoken and/or not justified assumptions. The purpose of this work is twofold: on one hand, to shed light on the definition and on the physical meaning of voltage in the case of time varying quasi-static fields and, on the other hand, to show how to establish coupling equations between lumped parameters circuit model and 2D/3D computational domains. It is demonstrated that a precise physical significance can be given to the voltage in terms of power balance only (the notion of potential is unnecessary). A couple of original operators which allow to express voltages and currents are introduced. Based on a critical analysis of the research literature, it is shown that existing coupling formulas can all be rewritten as particular cases of these two operators. The developed analysis is independent from any computational method and can be used to devise new coupling formulas. Full article
(This article belongs to the Special Issue Computation of Electromagnetic Fields)
Show Figures

Figure 1

16 pages, 2553 KiB  
Review
Recent Developments of Computational Methods for pKa Prediction Based on Electronic Structure Theory with Solvation Models
by Ryo Fujiki, Toru Matsui, Yasuteru Shigeta, Haruyuki Nakano and Norio Yoshida
J 2021, 4(4), 849-864; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040058 - 10 Dec 2021
Cited by 7 | Viewed by 3297
Abstract
The protonation/deprotonation reaction is one of the most fundamental processes in solutions and biological systems. Compounds with dissociative functional groups change their charge states by protonation/deprotonation. This change not only significantly alters the physical properties of a compound itself, but also has a [...] Read more.
The protonation/deprotonation reaction is one of the most fundamental processes in solutions and biological systems. Compounds with dissociative functional groups change their charge states by protonation/deprotonation. This change not only significantly alters the physical properties of a compound itself, but also has a profound effect on the surrounding molecules. In this paper, we review our recent developments of the methods for predicting the Ka, the equilibrium constant for protonation reactions or acid dissociation reactions. The pKa, which is a logarithm of Ka, is proportional to the reaction Gibbs energy of the protonation reaction, and the reaction free energy can be determined by electronic structure calculations with solvation models. The charge of the compound changes before and after protonation; therefore, the solvent effect plays an important role in determining the reaction Gibbs energy. Here, we review two solvation models: the continuum model, and the integral equation theory of molecular liquids. Furthermore, the reaction Gibbs energy calculations for the protonation reactions require special attention to the handling of dissociated protons. An efficient method for handling the free energy of dissociated protons will also be reviewed. Full article
(This article belongs to the Special Issue Advance in Molecular Thermodynamics)
Show Figures

Figure 1

11 pages, 1509 KiB  
Article
Search for Multi-Coincidence Cosmic Ray Events over Large Distances with the EEE MRPC Telescopes
by Marcello Abbrescia, Carlo Avanzini, Luca Baldini, Rinaldo Baldini Ferroli, Giovanni Batignani, Marco Battaglieri, Stefano Boi, Edoardo Bossini, Francesca Carnesecchi, Corrado Cicalò, Luisa Cifarelli, Fabrizio Coccetti, Eugenio Coccia, Alessandro Corvaglia, Daniele De Gruttola, Salvatore De Pasquale, Franco Fabbri, Lorenzo Galante, Marco Garbini, Gianluca Gemme, Ivan Gnesi, Stefano Grazzi, Despina Hatzifotiadou, Paola La Rocca, Zhang Liu, Giuseppe Mandaglio, Gaetano Maron, Mario Nicola Mazziotta, Alice Mulliri, Rosario Nania, Francesco Noferini, Francesco Nozzoli, Federico Palmonari, Marco Panareo, Maria Paola Panetta, Riccardo Paoletti, Carmelo Pellegrino, Ombretta Pinazza, Chiara Pinto, Silvia Pisano, Francesco Riggi, Giancarlo Righini, Cristina Ripoli, Matteo Rizzi, Gabriella Sartorelli, Eugenio Scapparone, Marco Schioppa, Angelo Scribano, Marco Selvi, Gabriella Serri, Sandro Squarcia, Marco Taiuti, Giuseppe Terreni, Antonio Trifirò, Marina Trimarchi, Cristina Vistoli, Lucia Votano, Crispin Williams, Antonino Zichichi and Roman Zuyeuskiadd Show full author list remove Hide full author list
J 2021, 4(4), 838-848; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040057 - 01 Dec 2021
Cited by 1 | Viewed by 2405
Abstract
The existence of independent, yet time correlated, Extensive Air Showers (EAS) has been discussed over the past years, with emphasis on possible physical mechanisms that could justify their observation. The detector network of the Extreme Energy Events (EEE) Collaboration, with its approximately 60 [...] Read more.
The existence of independent, yet time correlated, Extensive Air Showers (EAS) has been discussed over the past years, with emphasis on possible physical mechanisms that could justify their observation. The detector network of the Extreme Energy Events (EEE) Collaboration, with its approximately 60 cosmic ray telescopes deployed over the Italian territory, has the potential to search for such events, employing different analysis strategies. In this paper, we have analyzed a set of EEE data, corresponding to an approximately five month observation period, searching for multi-coincidence events among several far telescopes, within a time window of 1 ms. Events with up to 12 coincident telescopes have been observed. Results were compared to expectations from a random distribution of events and discussed with reference to the relativistic dust grain hypothesis. Full article
(This article belongs to the Special Issue Dark Matter and Cosmic Rays)
Show Figures

Figure 1

14 pages, 1193 KiB  
Review
Potential Roles of Modified Pectin Targeting Galectin-3 against Severe Acute Respiratory Syndrome Coronavirus-2
by Frederick Odun-Ayo and Lalini Reddy
J 2021, 4(4), 824-837; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040056 - 29 Nov 2021
Cited by 1 | Viewed by 5591
Abstract
Modified pectin (MP) is a bioactive complex polysaccharide that is broken down into smaller fragments of units and used as an oral dietary supplement for cell proliferation. MP is safe and non-toxic with promising therapeutic properties with regard to targeting galectin-3 (GAL-3) toward [...] Read more.
Modified pectin (MP) is a bioactive complex polysaccharide that is broken down into smaller fragments of units and used as an oral dietary supplement for cell proliferation. MP is safe and non-toxic with promising therapeutic properties with regard to targeting galectin-3 (GAL-3) toward the prevention and inhibition of viral infections through the modulation of the immune response and anti-inflammatory cytokine effects. This effect of MP as a GAL-3 antagonism, which has shown benefits in preclinical and clinical models, may be of relevance to the progression of the novel severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) in coronavirus disease 2019 patients. The outbreak of emerging infectious diseases continues to pose a threat to human health. Further to the circulation of multiple variants of SARS-CoV-2, an effective and alternative therapeutic approach to combat it has become pertinent. The use of MP as a GAL-3 inhibitor could serve as an antiviral agent blocking against the SARS-CoV-2-binding spike protein. This review highlights the potential effects of MP in viral infections, its proposed role as a GAL-3 inhibitor, and the associated function concerning a SARS-CoV-2 infection. Full article
(This article belongs to the Section Medicine & Pharmacology)
Show Figures

Figure 1

21 pages, 4037 KiB  
Article
On the Thermal Dynamics of Metallic and Superconducting Wires. Bifurcations, Quench, the Destruction of Bistability and Temperature Blowup
by Rizos N. Krikkis
J 2021, 4(4), 803-823; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040055 - 22 Nov 2021
Viewed by 1890
Abstract
In the present study, a numerical bifurcation analysis is carried out in order to investigate the multiplicity and the thermal runaway features of metallic and superconducting wires in a unified framework. The analysis reveals that the electrical resistance, combined with the boiling curve, [...] Read more.
In the present study, a numerical bifurcation analysis is carried out in order to investigate the multiplicity and the thermal runaway features of metallic and superconducting wires in a unified framework. The analysis reveals that the electrical resistance, combined with the boiling curve, are the dominant factors shaping the conditions of bistability—which result in a quenching process—and the conditions of multistability—which may lead to a temperature blowup in the wire. An interesting finding of the theoretical analysis is that, for the case of multistability, there are two ways that a thermal runaway may be triggered. One is associated with a high current value (“normal” runaway) whereas the other one is associated with a lower current value (“premature” runaway), as has been experimentally observed with certain types of superconducting magnets. Moreover, the results of the bifurcation analysis suggest that a static criterion of a warm or a cold thermal wave propagation may be established based on the limit points obtained. Full article
(This article belongs to the Special Issue Applied Superconductivity and Magnetism)
Show Figures

Figure 1

9 pages, 259 KiB  
Article
Observational Study of Hand Hygiene Compliance at a Trauma Hospital in Iraqi Kurdistan
by Ines Moued, Rawand M. Haweizy, Lawand S. Miran, Mustafa G. Mohammed, Johan von Schreeb and Andreas Älgå
J 2021, 4(4), 794-802; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040054 - 22 Nov 2021
Viewed by 3258
Abstract
Healthcare-associated infections, commonly caused by poor hand hygiene, represent a significant source of disease and economic burden for healthcare systems, especially those in resource-limited settings. The few existing studies on hand hygiene compliance in resource-limited hospital settings suggest that compliance is insufficient. The [...] Read more.
Healthcare-associated infections, commonly caused by poor hand hygiene, represent a significant source of disease and economic burden for healthcare systems, especially those in resource-limited settings. The few existing studies on hand hygiene compliance in resource-limited hospital settings suggest that compliance is insufficient. The difference in compliance rates between units in resource-limited trauma hospitals is largely unknown. We aimed to assess hand hygiene compliance rates among healthcare workers at a trauma hospital in Iraqi Kurdistan and compare the levels of compliance between the emergency room (ER), the intensive care unit (ICU), and the acute care ward (ACW). We carried out overt observations in 2018 using the validated World Health Organization ‘five moments for hand hygiene’ observational tool. We observed a total of 622 hand hygiene opportunities performed by 149 healthcare workers. Hand hygiene compliance was defined as handwashing with soap and water or the use of alcohol-based hand rub, in accordance with the ‘five moments for hand hygiene’ concept. Overall, the hand hygiene compliance rate was found to be 6.8% (95% confidence interval 5.0–9.1). Compliance was significantly lower in the ER (1.0%), compared with the ICU (8.1%) (p = 0.0012), and the ACW (11.1%) (p < 0.0001). In all three units, the availability of alcohol-based hand rub and handwashing sinks was insufficient in relation to the number of patient beds. We conclude that the overall level of hand hygiene compliance was low, with the lowest level of compliance in the ER. Our findings call for improved resource allocation and strengthened hand hygiene routines. These relatively simple measures could potentially lower the incidence of healthcare-associated infections and improve the mortality and morbidity of patients in already overburdened healthcare systems. Full article
10 pages, 236 KiB  
Article
Nothing to Be Happy about: Consumer Emotions and AI
by Mateja Durovic and Jonathon Watson
J 2021, 4(4), 784-793; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040053 - 16 Nov 2021
Cited by 1 | Viewed by 3553
Abstract
Advancements in artificial intelligence and Big Data allow for a range of goods and services to determine and respond to a consumer’s emotional state of mind. Considerable potential surrounds the technological ability to detect and respond to an individual’s emotions, yet such technology [...] Read more.
Advancements in artificial intelligence and Big Data allow for a range of goods and services to determine and respond to a consumer’s emotional state of mind. Considerable potential surrounds the technological ability to detect and respond to an individual’s emotions, yet such technology is also controversial and raises questions surrounding the legal protection of emotions. Despite their highly sensitive and private nature, this article highlights the inadequate protection of emotions in aspects of data protection and consumer protection law, arguing that the contribution by recent proposal for an Artificial Intelligence Act is not only unsuitable to overcome such deficits but does little to support the assertion that emotions are highly sensitive. Full article
(This article belongs to the Special Issue The Impact of Artificial Intelligence on Law)
20 pages, 3088 KiB  
Article
A Novel True Random Number Generator in Near Field Communication as Memristive Wireless Power Transmission
by Colin Sokol Kuka, Yihua Hu, Quan Xu, James Chandler and Mohammed Alkahtani
J 2021, 4(4), 764-783; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040052 - 11 Nov 2021
Viewed by 2700
Abstract
The security of powering systems has been a major problem over the last decade, leading to an increased interest in wireless power and data transfer. In this research paper, a new inductive Wireless Power Transfer (WPT) circuit topology has been used. In traditional [...] Read more.
The security of powering systems has been a major problem over the last decade, leading to an increased interest in wireless power and data transfer. In this research paper, a new inductive Wireless Power Transfer (WPT) circuit topology has been used. In traditional WPT circuits, the inverters are used to produce an oscillation for the transmitter coils. The classic WPT system includes intrinsic energy dissipation sources due to the use of switches, necessitating the need of an extra control circuit to ensure proper switching time. Furthermore, they have limited data encryption capabilities. As a result, an unique WPT system based on memristors has been developed, eliminating the need for switches. Furthermore, because this novel topology communicates a synchronised chaotic behaviour, it becomes highly beneficial. This circuit may be used in Near Field Communication (NFC), where chaotic true random numbers (TRNG) can be generated to increase security. The results of simulations indicate the functioning of the Memristor-based WPT (M-WPT) and its ability to generate random numbers. We experimentally proved the chaotic behaviour of the circuit and statistically demonstrated the development of the TRNG, using an Arduino board and the Chua circuit to build the M-WPT circuit. Full article
(This article belongs to the Section Computer Science & Mathematics)
Show Figures

Graphical abstract

15 pages, 433 KiB  
Article
The Ethical Assessment of Autonomous Systems in Practice
by Daniel Trusilo and Thomas Burri
J 2021, 4(4), 749-763; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040051 - 10 Nov 2021
Cited by 1 | Viewed by 5154
Abstract
This paper presents the findings of a study that used applied ethics to evaluate autonomous robotic systems practically. Using a theoretical tool developed by a team of researchers in 2017, which one of the authors contributed to, we conducted a study of four [...] Read more.
This paper presents the findings of a study that used applied ethics to evaluate autonomous robotic systems practically. Using a theoretical tool developed by a team of researchers in 2017, which one of the authors contributed to, we conducted a study of four existing autonomous robotic systems in July 2020. The methods used to carry out the study and the results are highlighted by examining the specific example of ANYmal, an autonomous robotic system that is one component of the CERBERUS team that won first place in DARPA’s Subterranean Challenge Systems Competition in September 2021. Full article
(This article belongs to the Special Issue The Impact of Artificial Intelligence on Law)
Show Figures

Figure A1

22 pages, 8917 KiB  
Article
Nonlinear Metamaterial Lenses for Inductive Power Transmission Systems Using Duffing-Resonator Based Unit Cells
by Jorge Virgilio de Almeida, Xiaoqiang Gu, Marbey Manhães Mosso, Carlos Antonio França Sartori and Ke Wu
J 2021, 4(4), 727-748; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040050 - 08 Nov 2021
Cited by 2 | Viewed by 2302
Abstract
Metamaterials (MTMs) based on a periodic array of resonant coils have been shown to behave as μ-negative (MNG), enabling the focusing of magnetic flux. The phenomenon has been deployed by designers to boost the efficiency of many inductively coupled systems, such as magnetic [...] Read more.
Metamaterials (MTMs) based on a periodic array of resonant coils have been shown to behave as μ-negative (MNG), enabling the focusing of magnetic flux. The phenomenon has been deployed by designers to boost the efficiency of many inductively coupled systems, such as magnetic resonance imaging, underwater and underground communications, and charging base stations (CBS) for consumer electronics and implanted devices. However, due to their dependency on high-Q unit cells, linear MNG-like MTMs have limited bandwidth, restricting their use in many applications, notably in near-field simultaneous wireless information and power transmission (NF-SWIPT) systems. To improve the tight constraints of the amplitude-bandwidth trade-off of artificial magnetic lenses, this paper presents a theoretical analysis of nonlinear MTMs based on a lattice of Duffing resonators (DRs). Additionally, it introduces a criterium for the quantification and evaluation of the amplitude-bandwidth enhancement. The analytical results are based on a circuit model and further verified by numerical simulations using commercial software. The preliminary findings in this paper open up possibilities for nonlinear MTM lenses and can be applied to enhance the linear amplitude-bandwidth limit. Full article
(This article belongs to the Special Issue Computation of Electromagnetic Fields)
Show Figures

Figure 1

29 pages, 5343 KiB  
Review
Structure and Properties of Supercritical Water: Experimental and Theoretical Characterizations
by Norio Yoshida, Masaru Matsugami, Yuichi Harano, Keiko Nishikawa and Fumio Hirata
J 2021, 4(4), 698-726; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040049 - 02 Nov 2021
Cited by 6 | Viewed by 3343
Abstract
Water in the supercritical region of the phase diagram exhibits a markedly different structure and properties from that at ambient conditions, which is useful in controlling chemical reactions. Nonetheless, the experimental, as well as theoretical, characterization of the substance is not easy because [...] Read more.
Water in the supercritical region of the phase diagram exhibits a markedly different structure and properties from that at ambient conditions, which is useful in controlling chemical reactions. Nonetheless, the experimental, as well as theoretical, characterization of the substance is not easy because the region is next to the critical point. This article reviews the experimental as well as theoretical studies on water in the supercritical region and its properties as a solvent for chemical reactions, as carried out by the authors and based on small-angle X-ray scattering and the statistical mechanics theory of molecular liquids, also known as reference interaction-site model (RISM) theory. Full article
(This article belongs to the Special Issue Advance in Molecular Thermodynamics)
Show Figures

Figure 1

34 pages, 456753 KiB  
Review
Robotic Psychology: A PRISMA Systematic Review on Social-Robot-Based Interventions in Psychological Domains
by Mirko Duradoni, Giulia Colombini, Paola Andrea Russo and Andrea Guazzini
J 2021, 4(4), 664-697; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040048 - 26 Oct 2021
Cited by 6 | Viewed by 5618
Abstract
Current technological advancements have allowed robots to be successfully employed in the healthcare sector. However, the recently acquired ability of social robots to process social information and act according to it has potentially made them very well suited to support or conduct psychological [...] Read more.
Current technological advancements have allowed robots to be successfully employed in the healthcare sector. However, the recently acquired ability of social robots to process social information and act according to it has potentially made them very well suited to support or conduct psychological interventions. The present paper carried out a systematic review of the available literature regarding social-robot-based interventions in psychological domains using preferred reporting items for systematic reviews and meta-analyses (PRISMA) guidelines. The inclusion criteria were: (i) publication date until 2020; (ii) being an empirical study, master thesis, or project report; (iii) written in English or Italian languages (the two languages spoken by the authors); (iv) published in a scholarly peer-reviewed journal or conference proceedings, or were Ph.D. or master’s theses; and (v) assessed “social robot”-based intervention in psychological domains. Overall, the review showed that three main areas may benefit from social-robot-based interventions: social skills, mood, and wellbeing (e.g., stress and anxiety levels). Interestingly, social robots seemed to have a performance comparable to, and sometimes even better than, human operators. The main, but not exclusive, target of robot-based interventions in the psychological field was children with autism spectrum disorder (ASD). As evidence is, however, still limited and in an embryonic state, deeper investigations are needed to assess the full potential of social robots for the purposes of psychological intervention. This is relevant, considering the role that social robots could have in overcoming barriers to access psychological assessment and therapies. Full article
(This article belongs to the Special Issue IT Support in the Healthcare Sector)
Show Figures

Figure 1

19 pages, 577 KiB  
Article
Energetics of Urban Canopies: A Meteorological Perspective
by Edson R. Marciotto and Marcos Vinicius Bueno de Morais
J 2021, 4(4), 645-663; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040047 - 25 Oct 2021
Cited by 1 | Viewed by 1993
Abstract
The urban climatology consists not only of the urban canopy temperature but also of wind regime and boundary layer evolution among other secondary variables. The energetic input and response of urbanized areas is rather different to rural or forest areas. In this paper, [...] Read more.
The urban climatology consists not only of the urban canopy temperature but also of wind regime and boundary layer evolution among other secondary variables. The energetic input and response of urbanized areas is rather different to rural or forest areas. In this paper, we outline the physical characteristics of the urban canopy that make its energy balance depart from that of vegetated areas and change local climatology. Among the several canopy characteristics, we focus on the aspect ratio h/d and its effects. The literature and methods of retrieving meteorological quantities in urban areas are reviewed and a number of physical analyzes from conceptual or numerical models are presented. In particular, the existence of a maximum value for the urban heat island intensity is discussed comprehensively. Changes in the local flow and boundary layer evolution due to urbanization are also discussed. The presence of vegetation and water bodies in urban areas are reviewed. The main conclusions are as follows: for increasing h/d, the urban heat island intensity is likely to attain a peak around h/d4 and decrease for h/d>4; the temperature at the pedestrian level follows similar behavior; the urban boundary layer grows slowly, which in combination with low wind, can worsen pollution dispersion. Full article
(This article belongs to the Special Issue Sustainable and Resource – Efficient Homes and Communities)
Show Figures

Figure 1

7 pages, 625 KiB  
Article
Accurate Absorption Energy Calculations in Solution Using the Reference Interaction Site Model Self-Consistent Field Including the Constrained Spatial Electron Density Distribution
by Daisuke Yokogawa
J 2021, 4(4), 638-644; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040046 - 22 Oct 2021
Viewed by 1846
Abstract
The solvation effect is an important factor determining the properties of molecules in solution. The reference interaction site model (RISM) is a powerful method to treat the solvation effect with pair-correlation functions, such as a radial distribution function. This study developed a hybrid [...] Read more.
The solvation effect is an important factor determining the properties of molecules in solution. The reference interaction site model (RISM) is a powerful method to treat the solvation effect with pair-correlation functions, such as a radial distribution function. This study developed a hybrid method between quantum mechanics and RISM using the spatial electron density distributions on each atomic site (RISM-SCF-cSED). Sophisticated quantum mechanical approaches can be used to consider the solvation effect because the computational cost of RISM-SCF-cSED is reasonable. In this study, the absorption energies of 5-(dimethylamino)-2,4-pentadienal in various solutions were calculated using RISM-SCF-cSED. The experimental data were well reproduced with an average errors of ∼0.06 eV, using multi-reference perturbation theory. Full article
(This article belongs to the Special Issue Advance in Molecular Thermodynamics)
Show Figures

Figure 1

24 pages, 2684 KiB  
Article
Can a Wastewater Treatment Plant Power Itself? Results from a Novel Biokinetic-Thermodynamic Analysis
by Mustafa Erguvan and David W. MacPhee
J 2021, 4(4), 614-637; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040045 - 21 Oct 2021
Viewed by 2376
Abstract
The water–energy nexus (WEN) has become increasingly important due to differences in supply and demand of both commodities. At the center of the WEN is wastewater treatment plants (WWTP), which can consume a significant portion of total electricity usage in many developed countries. [...] Read more.
The water–energy nexus (WEN) has become increasingly important due to differences in supply and demand of both commodities. At the center of the WEN is wastewater treatment plants (WWTP), which can consume a significant portion of total electricity usage in many developed countries. In this study, a novel multigeneration energy system has been developed to provide an energetically self-sufficient WWTP. This system consists of four major subsystems: an activated sludge process, an anerobic digester, a gas power (Brayton) cycle, and a steam power (Rankine) cycle. Furthermore, a novel secondary compressor has been attached to the Brayton cycle to power aeration in the activated sludge system in order to increase the efficiency of the overall system. The energy and exergy efficiencies have been investigated by varying several parameters in both WWTP and power cycles. The effect of these parameters (biological oxygen demand, dissolved oxygen level, turbine inlet temperature, compression ratio and preheater temperature) on the self-efficiency has also been investigated. It was found here that up to 109% of the wastewater treatment energy demand can be produced using the proposed system. The turbine inlet temperature of the Brayton cycle has the largest effect on self-sufficiency of the system. Energy and exergy efficiencies of the overall system varied from 35.7% to 46.0% and from 30.6% to 33.55%, respectively. Full article
(This article belongs to the Section Engineering)
Show Figures

Figure 1

10 pages, 769 KiB  
Article
Benchmarking Free Energy Calculations in Liquid Aliphatic Ketone Solvents Using the 3D-RISM-KH Molecular Solvation Theory
by Dipankar Roy and Andriy Kovalenko
J 2021, 4(4), 604-613; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040044 - 13 Oct 2021
Cited by 1 | Viewed by 2201
Abstract
The three-dimensional reference interaction site model of the molecular solvation theory with the Kovalenko–Hirata closure is used to calculate the free energy of solvation of organic solutes in liquid aliphatic ketones. The ketone solvent sites were modeled using a modified united-atom force field. [...] Read more.
The three-dimensional reference interaction site model of the molecular solvation theory with the Kovalenko–Hirata closure is used to calculate the free energy of solvation of organic solutes in liquid aliphatic ketones. The ketone solvent sites were modeled using a modified united-atom force field. The successful application of these solvation models in calculating ketone–water partition coefficients of a large number of solutes supports the validation and benchmarking reported here. Full article
(This article belongs to the Special Issue Advance in Molecular Thermodynamics)
Show Figures

Figure 1

15 pages, 291 KiB  
Article
The European Commission’s Proposal for an Artificial Intelligence Act—A Critical Assessment by Members of the Robotics and AI Law Society (RAILS)
by Martin Ebers, Veronica R. S. Hoch, Frank Rosenkranz, Hannah Ruschemeier and Björn Steinrötter
J 2021, 4(4), 589-603; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040043 - 08 Oct 2021
Cited by 27 | Viewed by 15085
Abstract
On 21 April 2021, the European Commission presented its long-awaited proposal for a Regulation “laying down harmonized rules on Artificial Intelligence”, the so-called “Artificial Intelligence Act” (AIA). This article takes a critical look at the proposed regulation. After an introduction (1), the paper [...] Read more.
On 21 April 2021, the European Commission presented its long-awaited proposal for a Regulation “laying down harmonized rules on Artificial Intelligence”, the so-called “Artificial Intelligence Act” (AIA). This article takes a critical look at the proposed regulation. After an introduction (1), the paper analyzes the unclear preemptive effect of the AIA and EU competences (2), the scope of application (3), the prohibited uses of Artificial Intelligence (AI) (4), the provisions on high-risk AI systems (5), the obligations of providers and users (6), the requirements for AI systems with limited risks (7), the enforcement system (8), the relationship of the AIA with the existing legal framework (9), and the regulatory gaps (10). The last section draws some final conclusions (11). Full article
(This article belongs to the Special Issue The Impact of Artificial Intelligence on Law)
12 pages, 647 KiB  
Article
Computational Prediction of New Series of Topological Ternary Compounds LaXS (X = Si, Ge, Sn) from First-Principles
by Jack Howard, Joshua Steier, Neel Haldolaarachchige and Kalani Hettiarachchilage
J 2021, 4(4), 577-588; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040042 - 30 Sep 2021
Viewed by 2499
Abstract
Dirac materials and their advanced physical properties are one of the most active fields of topological matter. In this paper, we present an ab initio study of electronics properties of newly designed LaXS (X = Si, Ge, Sn) tetragonal structured [...] Read more.
Dirac materials and their advanced physical properties are one of the most active fields of topological matter. In this paper, we present an ab initio study of electronics properties of newly designed LaXS (X = Si, Ge, Sn) tetragonal structured ternaries, with the absence and presence of spin–orbit coupling. We design the LaXS tetragonal non-symophic p4/nmm space group (no. 129) structures and identify their optimization lattice parameters. The electronic band structures display several Dirac crossings with the coexistence of both type I and type II Dirac points identified by considering the effect of spin–orbit coupling toward the linear crossing. Additionally, we perform the formation energy calculation through the density functional theory (DFT) to predict the stability of the structures and the elastic constants calculations to verify the Born mechanical stability criteria of the compounds. Full article
(This article belongs to the Special Issue Quantum Matter with Topological Properties)
Show Figures

Figure 1

13 pages, 729 KiB  
Article
A Systems and Control Theory Approach for Law and Artificial Intelligence: Demystifying the “Black-Box”
by Woodrow Barfield
J 2021, 4(4), 564-576; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040041 - 27 Sep 2021
Cited by 2 | Viewed by 3939
Abstract
In this paper, I propose a conceptual framework for law and artificial intelligence (AI) that is based on ideas derived from systems and control theory. The approach considers the relationship between the input to an AI-controlled system and the system’s output, which may [...] Read more.
In this paper, I propose a conceptual framework for law and artificial intelligence (AI) that is based on ideas derived from systems and control theory. The approach considers the relationship between the input to an AI-controlled system and the system’s output, which may affect events in the real-world. The approach aims to add to the current discussion among legal scholars and legislators on how to regulate AI, which focuses primarily on how the output, or external behavior of a system, leads to actions that may implicate the law. The goal of this paper is to show that not only is the systems output an important consideration for law and AI but so too is the relationship between the systems input to its desired output, as mediated through a feedback loop (and other control variables). In this paper, I argue that ideas derived from systems and control theory can be used to provide a conceptual framework to help understand how the law applies to AI, and particularly, to algorithmically based systems. Full article
(This article belongs to the Special Issue The Impact of Artificial Intelligence on Law)
Show Figures

Figure 1

20 pages, 2265 KiB  
Article
Ethno-Veterinary Survey and Quantitative Study of Medicinal Plants with Anthelmintic Potential Used by Sheep and Goat Breeders in the Cotton Zone of Central Benin (West Africa)
by Christian Cocou Dansou, Pascal Abiodoun Olounladé, Basile Saka Boni Konmy, Oriane Songbé, Kisito Babatoundé Arigbo, André Boha Aboh, Latifou Lagnika and Sylvie Mawulé Hounzangbé-Adoté
J 2021, 4(4), 544-563; https://0-doi-org.brum.beds.ac.uk/10.3390/j4040040 - 26 Sep 2021
Cited by 4 | Viewed by 2721
Abstract
This study presents the diversity of anthelmintic plants in the cotton zone of Central Benin. The aim was to identify the medicinal anthelmintic plants used by small ruminant breeders in cotton zone of Central Benin to treat gastrointestinal parasites. Three hundred and sixty [...] Read more.
This study presents the diversity of anthelmintic plants in the cotton zone of Central Benin. The aim was to identify the medicinal anthelmintic plants used by small ruminant breeders in cotton zone of Central Benin to treat gastrointestinal parasites. Three hundred and sixty breeders were selected during individual semi-structured face-to-face interviews. Different quantitative indices of cultural importance were calculated in order to determine the level of use of plant species. Jaccard similarity index (JI) was calculated and Pearson’s correlation was determined for Use Value (UV) and Relative Frequency of Citation (RFC). In this study, a total of 99 medicinal species, of which 63 have anthelmintic potential, were listed, including Khaya senegalensis, Launaea taraxacifolia, Napoleonaea vogelii, Momordica charantia and Vernonia amygdalina, which all had UV and RFC above 20%. Each of them had a Fidelity Level above 50% and an Informant Agreement Rate (IAR) value close to one. Pearson’s correlation showed a significant correlation between RFC and UV with r = 0.94, and the studies were clearly independent (IJ < 50%). This study showed that the cotton zone of Central Benin represents 4% of the total flora of Benin, with many anthelmintic plants such as Launaea taraxacifolia and Napoleonaea vogelii that require further investigation. Full article
(This article belongs to the Section Biology & Life Sciences)
Show Figures

Figure 1

Previous Issue
Next Issue
Back to TopTop