Ab initio investigation of benzene clusters: molecular tailoring approach.

Ab initio investigation of benzene clusters: molecular tailoring approach.

Item
http://www.wikidata.org/entity/Q42843198
Energy decomposition analysis of cation-π, metal ion-lone pair, hydrogen bonded, charge-assisted hydrogen bonded, and π-π interactions.Exploring energy landscapes: from molecular to mesoscopic systems.Computational electrochemistry: prediction of liquid-phase reduction potentials.Saturated vs. unsaturated hydrocarbon interactions with carbon nanostructuresDispersion interactions between urea and nucleobases contribute to the destabilization of RNA by urea in aqueous solution.Impact of the chirality and curvature of carbon nanostructures on their interaction with aromatics and amino acids.The effect of defect types on the electronic and optical properties of graphene nanoflakes physisorbed by ionic liquids.A combined theoretical and experimental study of phenol-(acetylene)n (n ≤ 7) clusters.Appraisal of molecular tailoring approach for large clusters.A theoretical study on structural, spectroscopic and energetic properties of acetamide clusters [CH3CONH2] (n=1-15).Low-energy structures of benzene clusters with a novel accurate potential surface.Accurate vibrational spectra via molecular tailoring approach: a case study of water clusters at MP2 level.Molecular cluster building algorithm: electrostatic guidelines and molecular tailoring approach.
P2860

Ab initio investigation of benzene clusters: molecular tailoring approach.

Item
http://www.wikidata.org/entity/Q42843198
description
2010 nî lūn-bûn
@nan
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
2010年论文
@zh
2010年论文
@zh-cn
name
Ab initio investigation of benzene clusters: molecular tailoring approach.
@en
Ab initio investigation of benzene clusters: molecular tailoring approach.
@nl
type
label
Ab initio investigation of benzene clusters: molecular tailoring approach.
@en
Ab initio investigation of benzene clusters: molecular tailoring approach.
@nl
prefLabel
Ab initio investigation of benzene clusters: molecular tailoring approach.
@en
Ab initio investigation of benzene clusters: molecular tailoring approach.
@nl
P1433
P1476
P2093
P2860
P304
P31
P356
P407
P433
P478
P577
P5875
P698
P356
P1433
P1476
Ab initio investigation of benzene clusters: molecular tailoring approach.
@en
P2093
P2860
P304
P31
P356
P407
P433
P478
P577
P5875
P698