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کلمات کلیدی: TD-DFT
موارد یافت شده: 3
1 - Conductance characteristics of naphthopyran as a light-sensitive molecular optical junction: a joint NEGF-DFT and TD-DFT study (چکیده)2 - Dioxidomolybdenum(VI) complexes of allyl N'-2-hydroxy-3-metho xybenzylidenecarbamohydrazonothioate: synthesis, spectral, and theoretical investigations (چکیده)
3 - Preparation, X-ray structure, spectral analysis, DFT calculation and thermal study on palladium(II) coordination compound with Schiff base derived from S-allyldithiocarbazate (چکیده)