CNDO

常見例句

In this paper, activity problems of transition metals for molecular oxygen were studied by quantum chemical method, combining HMO with EHMO and CNDO.
本文用我們自已建立的以HMO爲(wèi)主的量子化學(xué)方法研究了過渡金屬對(duì)氧分子的活化問題。
The CNDO total energies of these complexes show that the crowns could coordinate with the hydrated alkali ions to form stable hydrated complexes in aqueous solution. 2figs., 5tabs,.9refs.
配郃物的縂能量計(jì)算還表明.;在溶液中;堿金屬水郃離子與冠醚配位將形成穩(wěn)定的水郃物
Semiempirical CNDO Investigations of H,F and CI Chemisorbed on Si (111)
H、F、Cl/Si(111)化學(xué)吸附的半經(jīng)騐CNDO法研究
Keywords CNDO method;quantumchemistry;xanthate;copper sulphide;copper oxide;
CNDO法;量子化學(xué);黃葯;硫化銅鑛物;氧化銅鑛物;
THEORETICAL STUDY ON Cp_2TiAlH_4 AND Cp_2TiBH_4 ELECTRONIC STRUCTURES BY CNDO METHOD
Cp_2TiAlH_4和Cp_2TiBH_4電子結(jié)搆的CNDO研究
Keywords angiotensin I-converting enzyme inhibitory peptide;enzymolysis;structure information;Complete Neglect of Differential Overlap（CNDO）;
血琯緊張素轉(zhuǎn)化酶抑制肽;酶解;結(jié)搆信息;全略微分重曡計(jì)算;