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Computing chiroptical properties with first‐principles theoretical ...
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Orbitals of the chosen complete active space with six electrons and six ...
Natural bond orbital overlapping for different types of interaction ...
Orbitals of the chosen complete active space with six electrons and six ...
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The five outer valence molecular orbitals and the three virtual ...
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Structures of the 2-thiouracil (upper left), the three lowest-lying p ...
Molecular Geometry and Covalent Bonding Models, bonding angle HD ...
Alexander FATEEV | доцент | PhD | Tomsk State University, Tomsk ...
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Effects of paramagnetic Cu(II)-EDTA doping on (a) 1 H and (b) 17 O ...
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