Noncovalent Interactions in SIESTA Using the vdW-DF Functional: S22 Benchmark and Macrocyclic Structures.
about
Molecular modeling and infrared and Raman spectroscopy of the crystal structure of the chiral antiparasitic drug Praziquantel.Diamond as an inert substrate of graphene.A simplified implementation of van der Waals density functionals for first-principles molecular dynamics applications.Silver(I), gold(I) and palladium(II) complexes of a NHC-pincer ligand with an aminotriazine core: a comparison with pyridyl analogues.Structural Collapse of the Hydroquinone-Formic Acid Clathrate: A Pressure-Medium-Dependent Phase Transition.
P2860
Noncovalent Interactions in SIESTA Using the vdW-DF Functional: S22 Benchmark and Macrocyclic Structures.
description
2011 nî lūn-bûn
@nan
2011年の論文
@ja
2011年論文
@yue
2011年論文
@zh-hant
2011年論文
@zh-hk
2011年論文
@zh-mo
2011年論文
@zh-tw
2011年论文
@wuu
2011年论文
@zh
2011年论文
@zh-cn
name
Noncovalent Interactions in SI ...... rk and Macrocyclic Structures.
@en
type
label
Noncovalent Interactions in SI ...... rk and Macrocyclic Structures.
@en
prefLabel
Noncovalent Interactions in SI ...... rk and Macrocyclic Structures.
@en
P356
P1476
Noncovalent Interactions in SI ...... ark and Macrocyclic Structures
@en
P2093
Damien J Carter
P304
P356
10.1021/CT200679B
P577
2011-12-06T00:00:00Z