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Density functional theory studies of meso-alkynyl porphyrins

โœ Scribed by Wang, Zhiqiang; Day, Paul N.; Pachter, Ruth


Book ID
120044378
Publisher
American Institute of Physics
Year
1998
Tongue
English
Weight
410 KB
Volume
108
Category
Article
ISSN
0021-9606

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## Abstract A combined method of density functional theory (DFT) and statistics integral equation (SIE) for the determination of the pore size distribution (PSD) is developed based on the experimental adsorption data of nitrogen on activated mesocarbon microbead (AMCMB) at 77 K. The pores of AMCMB