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- Currently displaying 20441 - 20460 of 29877 publications
Giant contrast reversal in scanning tunnelling microscopy of zincporphyrin monolayers on graphite
Chemical Physics Letters
(2005)
402
121
(doi: 10.1016/j.cplett.2004.12.007)
Ab initio molecular dynamics simulation of the aqueous Ru 2+/Ru3+ redox reaction: The marcus perspective
The journal of physical chemistry. B
(2005)
109
6793
(doi: 10.1021/jp0455879)
An evaluation of the performane of chemistry transport models - Part 2: Detailed comparison with two selected campaigns
Atmos. Chem. Phys.
(2005)
5
107
(doi: 10.5194/acp-5-107-2005)
Numerical Simulation of Crystal Nucleation in Colloids
Advances in Polymer Science
(2005)
173
149
(doi: 10.1007/b99429)
Stereocontrolled Total Synthesis of (−)‐Aurisides A and B
Angewandte Chemie International Edition
(2005)
44
1130
(doi: 10.1002/anie.200462267)
Homeotropic alignment on surface-initiated liquid crystalline polymer brushes
Journal of Materials Chemistry
(2005)
15
381
(doi: 10.1039/b413670e)
Two-photon vibronic spectroscopy of allene at 7.0-10.5 eV: experiment and theory
Molecular Physics
(2005)
103
229
(doi: 10.1080/00268970512331317354)
Multiresolution quantum chemistry in multiwavelet bases: time-dependent density functional theory with asymptotically corrected potentials in local density and generalized gradient approximations
Molecular Physics
(2005)
103
413
(doi: 10.1080/00268970412331319236)
A new, low-temperature polymorph of O′-SiAlON
Journal of the American Ceramic Society
(2005)
81
2188
Beyond the isotropic atom model in crystal structure prediction of rigid molecules: Atomic multipoles versus point charges
Crystal Growth & Design
(2005)
5
1023
(doi: 10.1021/cg049651n)
A theory of vibrational frequency shifts revisited: application to dimers of LiH with the inert gases He, Ne, Ar and Kr
Molecular Physics
(2005)
103
257
(doi: 10.1080/00268970512331317336)
Inclusion of C60 into an adjustable porphyrin dimer generated by dynamic disulfide chemistry
Chemical Communications
(2005)
1276
(doi: 10.1039/b417951j)
Strong in vivo maturation compensates for structurally restricted H3 loops in antibody repertoires
J Biol Chem
(2005)
280
14114
(doi: 10.1074/jbc.m413011200)
Selective polymorph transformation via solvent-drop grinding
Chemical Communications
(2005)
880
(doi: 10.1039/b416980h)
CBED study of grain misorientations in AlGaN epilayers
Ultramicroscopy
(2005)
103
23
Comment on "A centroid molecular dynamics study of liquid para hydrogen and ortho deuterium" [J. Chem. Phys. 121, 6412 (2004)]
Journal of Chemical Physics
(2005)
122
057101
(doi: 10.1063/1.1839867)
Cover Picture: Self‐Assembly of the Octanuclear Cluster [Cu8(OH)10(NH2(CH2)2CH3)12]6+ and the One‐Dimensional N‐Propylcarbamate‐Linked Coordination Polymer {[Cu(O2CNH(CH2)2CH3)(NH2(CH2)2CH3)3](ClO4)}n (Chem. Eur. J. 3/2005)
Chemistry - A European Journal
(2005)
11
795
(doi: 10.1002/chem.200590008)
Self-assembly of the octanuclear cluster [Cu8(OH) 10(NH2(CH2)2CH3) 12]6+ and the one-dimensional N-propylcarbamate-linked coordination polymer {[Cu(O2CNH(CH2)2CH 3)(NH2(CH2)2CH3) 3]ClO4)}n
Chemistry – A European Journal
(2005)
11
825
(doi: 10.1002/chem.200400555)