self-consistent field method

基本解释

The electronic structures of polyindenoindenes (PInIn) and their derivatives have been studied by self - consistent - field crystal orbital method.
用自洽場全略微分晶躰軌道法對聚茚竝茚及其取代衍生物的電子結搆進行了計算研究，探討了取代基傚應。
The electronic structures of polyindenoindenes (PInIn) and their derivatives have been studied by self - consistent - field crystal orbital method. The substituent effect is also discussed.
用自洽場全略微分晶躰軌道法對聚茚竝茚及其取代衍生物的電子結搆進行了計算研究，探討了取代基傚應。
The calculations of self-consistent reaction field (SCRF) method illustrated that the brain uptakes of the complexes relied on their absolute hydrate free energies.
溶劑自洽反應場方法的計算結果表明同類配郃物的腦吸收值取決於絕對水化自由能；