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為主的量子化學(xué)方法研究了過渡金屬對氧分子的活化問題。
• 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.
  配合物的總能量計(jì)算還表明.;在溶液中;堿金屬水合離子與冠醚配位將形成穩(wěn)定的水合物
• 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)驗(yàn)CNDO法研究
• Keywords CNDO method;quantumchemistry;xanthate;copper sulphide;copper oxide;
  CNDO法;量子化學(xué);黃藥;硫化銅礦物;氧化銅礦物;
• 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)構(gòu)的CNDO研究
• Keywords angiotensin I-converting enzyme inhibitory peptide;enzymolysis;structure information;Complete Neglect of Differential Overlap（CNDO）;
  血管緊張素轉(zhuǎn)化酶抑制肽;酶解;結(jié)構(gòu)信息;全略微分重疊計(jì)算;
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