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MOLECULAR ELECTRONEGATIVITY IN DENSITY-FUNCTIONAL THEORY .1. DIRECT CALCULATION OF ATOMIC CHARGES IN A MOLECULE VIA ELECTRONEGATIVITY EQUALIZATION PRINCIPLE 期刊论文
SCIENCE IN CHINA SERIES B-CHEMISTRY, 1995, 卷号: 38, 期号: 5
作者:  SHEN, EZ;  YANG, ZZ
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