%0 Journal Article
%T 利用■E_(AB)/■R_(AB)方法直接求分子的平衡核间距
%A 郑世钧
%J 科学通报
%D 1985
%I 
%X 在CNDO近似中,分子体系的总能量可以表为单原子能量E_A及双原能量E_(AB)之和,在分子构型变动不大的范围内,可取■P_(μv)/■R_(AB)=0的近似于是■E_A/■R_(AB)=0,■E_总/■R_(AB)=■E_(AB)/■R_(AB),其中
%U http://www.alljournals.cn/get_abstract_url.aspx?pcid=01BA20E8BA813E1908F3698710BBFEFEE816345F465FEBA5&cid=7C7E63796F062382A606A3A9833B8C05&jid=B40D4BA57FF46E45205A09B4DC283152&aid=1EE436CD9568484331184D6794021D74&yid=74E41645C164CD61&vid=340AC2BF8E7AB4FD&iid=708DD6B15D2464E8&sid=750AE535ABE3D62A&eid=750AE535ABE3D62A&journal_id=0023-074X&journal_name=科学通报&referenced_num=0&reference_num=0