• Title/Summary/Keyword: intermediacy

Search Result 12, Processing Time 0.015 seconds

A Study on Operation Efficiency of Container Port by Comparison of Similar Ports (동종 항만군 분류를 통한 컨테이너항만의 운영효율화 방안에 관한 연구)

  • 정태원;곽규석
    • Journal of Korean Society of Transportation
    • /
    • v.19 no.1
    • /
    • pp.7-16
    • /
    • 2001
  • The Principle objective of this paper is to introduce a systematic approach to identifying similar container ports in Asia. For this, it analyses data on port facilities, port facility availability, port service level total container throughput, and economic index, by using Multidimentional Scaling (MDS) method. Based on the analysis it identifies five groupings of similar container ports in Asia within which Port comparison can be justifiably made, evaluates a present position of five groupings on the basis of factors used to compare container ports in Asia ; and finally proposes policy implications for operation efficiency of Pusan container port in comparison with Kaohsiung Port. The major implication is that both the Kaosuing and the Pusan port have to strengthen port facility to attract more traffic, and particularly, Pusan Port has to reinforce the number of berth, total length of berth. and yard areas.

  • PDF

MNDO Studies on Intramolecular Proton Transfer Equilibria of Acetamide and Methyl Carbamate$^1$

  • Lee, Ik-Choon;Kim, Chang-Kon;Seo, Heon-Su
    • Bulletin of the Korean Chemical Society
    • /
    • v.7 no.5
    • /
    • pp.395-399
    • /
    • 1986
  • Intramolecular proton transfer equilibria of acetamide and methyl carbamate have been studied theoretically by MNDO MO method. For both substrates, carbonyl-O protonated tautomer was found to be the most stable form, the next most stable one being N-protonated form. Gas phase proton transfers take place by the 1,3-proton rearrangement process and in all cases have prohibitively high activation barriers. When however one solvate water molecule participates in the process, the barriers are lowered substantially and the process proceeds in an intermolecular manner through the intermediacy of the water molecule via a triple-well type potential energy surface; three wells correspond to reactant(RC), intermediate(IC) and product complex(PC) of proton donor-acceptor pairs whereas two transition states(TS) have proton-bridge structure. General scheme of the process can be represented for a substrate with two basic centers(heteroatoms) of A and B as, $$ABH\limits^+\;+\;H_2O\;{\to}\;ABH\limits^+{\cdots}{\limits_{RC}}OH_2\;{\to}\;AB{\cdots}H\limits_{TS}^+{\cdots}{\limits_{1}}OH_2\;{\to}\;AB{\cdots}{\limits_{IC}}H\limits^+OH_2\;{\to}\;BA{\cdots}H\limits_{TS}^+{\cdots}{\limits_{2}}OH_2\;{\to}\;BA H\limits^+{\cdots}{\limits_{PC}}OH_2\;{\to}\;BAH\limits^+\;+\;H_2O$$ Involvement of a second solvate water had negligible effect on the relative stabilities of the tautomers but lowered barrier heights by 5∼6 Kcal/mol. It was calculated that the abundance of the methoxy-O protonated tautomer of the methyl carbamate will be negligible, since the tautomer is unfavorable thermodynamically as well as kinetically. Fully optimized stationary points are reported.