• Corrosion Science and Technology
• /
• 제23권1호
• /
• pp.20-32
• /
• 2024

Metal corrosion in acidic environments is a major issue in various industrial applications. This study evaluates the 4-piperonylideneaminoantipyrine (PPDAA) corrosion inhibition efficiency for mild steel in a hydrochloric acid (HCl) solution. The weight loss method was used to determine the corrosion inhibition efficiency at different concentrations and immersion time periods. Results revealed that the highest inhibition efficiency (94.3%) was achieved at 5 mM concentration after 5 hours of immersion time. To inspect the surface morphology of the inhibitor film on the mild steel surface, scanning electron microscopy (SEM) was used before and after immersion in 1.0 M HCl. Density functional theory (DFT) calculations were performed to investigate the molecular structure and electronic properties of the inhibitor molecule to understand the corrosion inhibition mechanism. Theoretical results showed that the inhibitor molecule can adsorb onto the mild steel surface through its nitrogen and oxygen atoms, forming a protective layer that prevents HCl corrosive attack. These findings highlight the potential of PPDAA as an effective corrosion inhibitor for mild steel in HCl solution. Moreover, combining experimental and theoretical approaches provides insights into the mechanism of corrosion inhibition, which is essential for developing effective strategies to prevent metal corrosion in acidic environments.

• 청정기술
• /
• 제28권3호
• /
• pp.210-217
• /
• 2022

붕소(Boron)은 희소자원으로 유리, 반도체 재료, 화약 등 다양한 용도로 사용되고 있는데, 우리나라의 경우 붕소를 전량 수입에 의존하고 있으며 전 세계 붕소 매장량과 현재 추세의 생산량을 고려하면 50년 이후 지상의 붕소는 고갈될 확률이 높다. 따라서 안정적 붕소의 공급을 위해 해수 내의 붕소를 회수할 수 있는 소재 및 공정의 개발이 요구된다. 이에 본 연구에서는 수용액 중 붕소를 회수하기 위한 소재로 전기방사 후 탄소화된 폴리아크릴로니트릴(polyacrylonitrile, PAN) 나노섬유를 도입하였다. 먼저 탄소섬유 표면의 붕소 흡착 기작을 이론적으로 구현하기 위해 범밀도함수이론(density functional method) 기반의 분자모델링 작업을 수행하였는데, 계산된 에너지도(energetics)에 따르면 붕소가 탄소섬유 표면에 흡착되는 화학반응이 가능한(viable) 것으로 판단되었다. 한편 전기방사로 제작된 PAN 나노섬유를 대기 중에서 안정화를 진행한 후 아르곤(Ar) 분위기에서 탄소화하였고 붕산 수용액에 담지시켰다. SEM과 Raman 분석을 통해 각각 전기방사와 탄소화가 잘 진행되었는지 확인하였고, XPS 분석을 통해 탄소섬유 표면에 질소가 잘 도핑되었는지 여부와 붕소의 흡착 여부를 확인하였다. 결과적으로 전기방사된 PAN으로부터 제작된 탄소섬유는 해수 내 붕소 회수에 사용될 수 있는 소재로 판단된다.

• Membrane and Water Treatment
• /
• 제5권1호
• /
• pp.31-40
• /
• 2014

Papermaking tobacco sheet is an important reclaimed process for cigarette making. Traditionally, the pressure driven membrane was often used to isolate the effective compounds from the tobacco sheet extract. However, this method is difficult to remove small ionic compounds. Besides, membrane fouling is a major problem for effective use of these pressure driven membrane technologies. In this study, the electrodialysis process is used to removal the chloride ions and nitrate ions, thus the smoking quality of papermaking tobacco sheet extract can get improved. Three types of electrolytes ($Na_2SO_4$, NaCl and HCl) are chosen to prevent the generation of precipitation. The results indicate that 0.1mol/L HCl at current density of $30mA/cm^2$ is the optimal condition for the electrodialysis process. The removal rates of the Cland $NO{_3}^-$ in tobacco sheet extract are 97% and 98.4%, respectively. The electrodialysis process cost was estimated to be 0.11$/L. Naturally, electrodialysis is not only technological feasible, environmental-friendly and economical-attractive for tobacco extract treatment.

• Carbon letters
• /
• 제26권
• /
• pp.81-87
• /
• 2018

Morphological differences in multi-layered graphene flakes or graphene nanoplatelets prepared by oxidative (rGO-NP, reduced graphene oxide-nanoplatelets) and non-oxidative (GIC-NP, graphite intercalation compound-nanoplatelets) routes were investigated with various analytical methods. Both types of NPs have similar specific surface areas but very different structural differences. Therefore, this study proposes an effective and simple method to identify structural differences in graphene-like allotropes. The adsorptive potential peaks of rGO-NP attained by the density functional theory method were found to be more scattered over the basal and non-basal regions than those of GIC-NP. Raman spectra and high resolution TEM images showed more distinctive crystallographic defects in the rGO-NP than in the GIC-NP. Because the R-ratio values of the edge and basal plane of the sample were maintained and relatively similar in the rGO-NP (0.944 for edge & 1.026 for basal), the discrepancy between those values in the GIC-NP were found to be much greater (0.918 for edge & 0.164 for basal). The electrical conductivity results showed a remarkable gap between the rGO-NP and GIC-NP attributed to their inherent morphological and crystallographic properties.

• 한국전기전자재료학회논문지
• /
• 제19권5호
• /
• pp.457-460
• /
• 2006

Y doped zinc oxide (YZO) thin films were deposited on F doped $SnO_2$ (FTO) glass substrate by sol-gel method using the spin-coating system. A homogeneous and stable solution was prepared by dissolving acetate in the solution added diethanolamine as sol-gel stabilizer. YZO films were obtained after preheated on the hot-plate for 5minute before each coating; the number of coating was 3 times. After the coating of last step, annealing of YZO films performed at $450^{\circ}C$ for 30 minute. In order to confirming of a ultraviolet ray interruption and down-conversion effects, optical properties of YZO films, transmission spectrum and fluorescent spectrum were used. Also, for understanding the obtained results by experiment, the elestronic state of YZO was calculated using the density functional theory The results obtained by experiment were compared with calculated structure. The detail of electronic structure was obtained by the discrete variational Xa (DV-Xa) method, which is a sort of molecular orbital full potential method. The density of state and energy levels of dopant element were shown and discussed in association with optical properties.

• 한국기계가공학회지
• /
• 제18권11호
• /
• pp.96-102
• /
• 2019

Reverse engineering involves duplicating a physical part by measuring and analyzing its physical dimensions, features, and material properties. By combining reverse engineering with three-dimensional (3D) printing, engineers can simply fabricate and evaluate functional prototypes. This design methodology has been attracting increasing interest with the advent of the Fourth Industrial Revolution. In the present study, we apply reverse engineering and 3D printing technologies to evaluate a fabricated automotive inner ring prototype. Through 3D printing, inner rings of various densities were prepared. Their physical dimensions were measured with a 3D scanning system. Of our interest was the effect of inner ring density on the physical dimensions of the fabricated prototype. We compared the design dimensions and physical dimensions of the fabricated prototypes. The results revealed that even the 20% density of inner ring was effective for 3D printing in terms of satisfying the design requirements.

• 대한족부족관절학회지
• /
• 제27권2호
• /
• pp.43-48
• /
• 2023

The incidence of osteoporotic ankle fractures is increasing as the population ages. These fractures are becoming more common in clinical practice and require careful management because of the higher likelihood of developing complications than typical ankle fractures. The introduction of a method for measuring the ankle joint bone mineral density is a valuable tool for assessing the bone quality of the ankle joint. By evaluating the bone mineral density, healthcare professionals can better understand the extent of osteoporosis and the overall strength of the ankle joint. This information is crucial for determining the appropriate treatment for individual fractures. Several factors must be considered when deciding on the treatment for osteoporotic ankle fractures. These include the ankle joint bone mineral density, skin condition, any comorbidities the patient may have, and the patient's functional demands. Taking these factors into consideration allows healthcare providers to tailor the treatment plan to the specific needs and the circumstances of each patient. By applying the appropriate treatment, it is expected that the complications associated with osteoporotic ankle fractures can be minimized, and the prognosis for patients can be improved.

• Bulletin of the Korean Chemical Society
• /
• 제24권8호
• /
• pp.1097-1101
• /
• 2003

The cubic and quartic anharmonic force field of malonaldehyde is calculated using density functional theory at the B3LYP/6-31G(d,p) level, and used to simulate coherent infrared vibrational spectra. 12 normal modes are included in the simulation, and the Arnoldi method is employed for the diagonalization of the Hamiltonian. The calculated three pulse infrared signals in the k1 + k2 - k3 direction show signatures of the intramolecular hydrogen bond couplings between the C=O stretch, H-O-C bend and O-H stretch vibrations.

• 대한화학회지
• /
• 제57권2호
• /
• pp.216-220
• /
• 2013

The hydroalumination of cyclopropane has been investigated using the B3LYP density functional method employing several split-valence basis sets. It is shown that the reaction proceeds via an intermediate weakly bound complex and a four-centered transition state. Calculations at higher levels of theory were also performed at the geometries optimized at the B3LYP level, but only slight changes in the barriers were observed. Structural parameters for the transition state are also reported.

• 한국통신학회논문지
• /
• 제21권4호
• /
• pp.869-875
• /
• 1996

This paper investigates a method for dtermining a threshold value based on the probability distribution function for color image segmentation. Principal components of normalized color is nalyzed and found that there are effective color transforms for outdoor scents. We esplain the functional relationship of the treshold and the probability of a regiona detection, asuming bivarate Gaussian probability density function. Experimental results show that the probability of detection is proportional to the segmented area.