Complexes of helium with neutral molecules: Progress toward a quantitative scale of bonding character
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DOI: 10.1002/jcc.26146
Abstract: The complexes of helium with nearly 30 neutral molecules (M) were investigated by various techniques of bonding analysis and symmetry‐adapted perturbation theory (SAPT). The main investigated function was the local electron energy density H(r), analyzed,… read more here.
Keywords: complexes helium; neutral molecules; bonding character; quantitative scale ... See more keywords
Partition of Neutral Molecules and Ions from Water to o-Nitrophenyl Octyl Ether and of Neutral Molecules from the Gas Phase to o-Nitrophenyl Octyl Ether
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DOI: 10.1007/s10953-018-0717-0
Abstract: We have set out an equation for partition of 87 neutral molecules from water to o-nitrophenyl octyl ether, NPOE, an equation for partition of the 87 neutral molecules and 21 ionic species from water to… read more here.
Keywords: neutral molecules; water; partition neutral; partition ... See more keywords
Theoretical Study on Neutral Molecules with Square Planar Tetracoordinate Oxygen O(B)4 Arrangements
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DOI: 10.1021/acsomega.0c02969
Abstract: As we know, oxygen usually forms two single bonds with other atoms, whereas in this work, we reported the neutral molecules with square planar O(B)4-type tetracoordinate oxygen substructures. The difficulty to achieve a square planar… read more here.
Keywords: oxygen; neutral molecules; planar type; square planar ... See more keywords