Scopus İndeksli Yayınlar Koleksiyonu
Permanent URI for this collectionhttps://hdl.handle.net/20.500.12573/395
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Conference Object Citation - Scopus: 1Data-Driven Discovery and DFT Modeling of Fe4H on the Atomistic Level(Elsevier B.V., 2024) Zagorac, Dejan; Zagorac, Jelena; Djukic, Milos B.; Bal, Burak; Schön, Johann ChristianSince their discovery, iron and hydrogen have been two of the most interesting elements in scientific research, with a variety of known and postulated compounds and applications. Of special interest in materials engineering is the stability of such materials, where hydrogen embrittlement has gained particular importance in recent years. Here, we present the results for the Fe-H system. In the past, most of the work on iron hydrides has been focused on hydrogen-rich compounds since they have a variety of interesting properties at extreme conditions (e.g. superconductivity). However, we present the first atomistic study of an iron-rich Fe4H compound which has been predicted using a combination of data mining and quantum mechanical calculations. Novel structures have been discovered in the Fe4H chemical system for possible experimental synthesis at the atomistic level. © 2024 Elsevier B.V., All rights reserved.Article Citation - WoS: 12Citation - Scopus: 12Biogas Intake Pressure and Port Air Swirl Optimization to Enhance the Diesel RCCI Engine Characteristics for Low Environmental Emissions(Elsevier, 2024) Dalha, Ibrahim B.; Koca, Kemal; Said, Mior A.; Rafindadi, Aminu D.Exhaust emission and combustion control in RCCI (reactivity-controlled compression ignition) focused mainly on the direct-injected fuel parameters, urging to investigate the advantages of port-fuel intake parameters. The engine was modified for port injection of Biogas at the valve and RCCI mode. The influence of port swirl ratio (PSR, 0 - 80%) and biogas injection pressure (BIP, 1 - 4 bar) on the diesel RCCI combustion and emissions was tested and optimized at varied loads and 1600 rpm in a port injection at the valve (PIVE) approach. Established kinetic mechanisms were combined with multi-objective optimization to further investigate, predict, and analyze emissions occurrence and trade-offs for reduced environmental impacts. The results show that the radiation absorption triggered by increased CO2 lowers combustion temperature, resulting in prolonged ignition. Setting the airflow to swirl lowers the in-cylinder pressure at elevated BIP while raising the heat generated across the BIPs. Increasing the PSR slows the combustion while BIP speeds up the process. BIP and PSR show great trade-off reduction ability among all emission parameters. The optimum unburned hydrocarbon, nitrogen oxide, particulate, and carbon monoxide emissions for the injection at the valve were found to be 109.58, 0.577, and 2.336 ppm, and 0.103%, respectively, at low-load, low-BIP, and high-PSR. The emissions were lowered by 6.58, 91.26, 80.65, and 13.45% compared to the premixed RCCI mode, respectively. Therefore, introducing lowpressure biogas amid high swirling air at the valve elevates the in-cylinder condition while lowering the emissions, mitigating their environmental implications.
