The charge transfer (CT) excitation energy calculations of H2N-(CH=CH)3-X and the H2N-H.....H-X structures with the various electron acceptors (-X) were performed with comparing the accuracy of various calculation methods, such as B3LYP, long-range corrected (LC)-BLYP, and EOM-CCSD. Both intra-molecular and inter-molecular systems showed a tendency for CT excitation energy to decrease as the electronic accepting property increases, and LC-BLYP showed the best accuracy in both inter- and intra-molecular CT excitation energy. In this study, it was confirmed that unexpectedly larger range separation parameter(μ) values of LC-BLYP showed better results of CT excitation energy.

In the present study, we developed optimal heat supply algorithm which minimizes the heat loss through the distribution pipe line in group energy apartment. Heating load variation of group energy apartment building in accordance with outdoor air temperature was predicted by the correlation obtained from calorimeter measurements of whole households of apartment building. Supply water temperature and mass flow rate were conjugately controlled to minimize the heat loss rate through distribution pipe line. Group heating apartment located in Hwaseong city, Korea, which has 1,473 households divided in 4 regions, was selected as the object apartment for verifying the present heat supply control algorithm. Compared to the original heat supply system, 10.4% heat loss rate reduction can be accomplished by employing the present control algorithm.