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- Currently displaying 15621 - 15640 of 29670 publications
A Special Issue in Honour of Professor Jean-Jacques Weis INTRODUCTION
Molecular Physics
(2010)
107
293
(doi: 10.1080/00268970902917781)
A study of sulphur-containing molecules using Hartree-Fock, MP2 and DFT (hybrid) methodologies
Molecular Physics
(2010)
92
339
(doi: 10.1080/00268979709482104)
An ab initio study of anharmonicity and matrix effects on the hydrogen-bonded BrH:NH3 complex
Molecular Physics
(2010)
92
429
(doi: 10.1080/00268979709482113)
Transferability of topologically partitioned polarizabilities: The case of n-alkanes
Molecular Physics
(2010)
89
595
(doi: 10.1080/002689796173930)
A density functional water dimer potential surface
Molecular Physics
(2010)
92
667
(doi: 10.1080/002689797169943)
Atomistic simulation of the stretching of nanoscale metal wires
Molecular Physics
(2010)
92
705
(doi: 10.1080/002689797169989)
Nuclear magnetic shielding surfaces for CH3 F, CH3 Cl, and CH3 Br
Molecular Physics
(2010)
92
773
(doi: 10.1080/002689797170040)
The derivation of vibration-rotation kinetic energy operators in internal coordinates. II
Molecular Physics
(2010)
92
317
(doi: 10.1080/002689797170527)
Efficient schemes to compute diffusive barrier crossing rates
Molecular Physics
(2010)
90
925
(doi: 10.1080/002689797171922)
Structure and properties of Nen+; clusters from a diatomics-in-molecules approach
Molecular Physics
(2010)
93
633
(doi: 10.1080/002689798168970)
Structure, rearrangements and evaporation of rotating atomic clusters
Molecular Physics
(2010)
89
533
(doi: 10.1080/002689796173895)
Screened electrostatic interactions between clay platelets
Molecular Physics
(2010)
98
1369
(doi: 10.1080/002689700417493)
Self-assembly of lamellar microphases in linear gradient copolymer melts
Macromolecules
(2010)
43
10612
(doi: 10.1021/ma102296r)
Phase Behavior of Heptanamide Adsorbed on a Graphite Substrate
Langmuir : the ACS journal of surfaces and colloids
(2010)
27
15
(doi: 10.1021/la1041053)
Solar hydrogen evolution with hydrogenases: From natural to hybrid systems
European Journal of Inorganic Chemistry
(2010)
2011
1005
(doi: 10.1002/ejic.201000986)
Silaindacenodithiophene semiconducting polymers for efficient solar cells and high-mobility ambipolar transistors
Chemistry of Materials
(2010)
23
768
(doi: 10.1021/cm1029744)
Symmetry pathways in solid-state NMR.
Progress in Nuclear Magnetic Resonance Spectroscopy
(2010)
59
121
(doi: 10.1016/j.pnmrs.2010.11.003)
Phase diagrams and surface properties of modified water models
Molecular Physics
(2010)
105
3029
(doi: 10.1080/00268970701733405)
Unveiling the neuromorphological space.
Frontiers in Computational Neuroscience
(2010)
4
150
(doi: 10.3389/fncom.2010.00150)
Detecting the "afterglow" of 13C NMR in proteins using multiple receivers.
J Am Chem Soc
(2010)
132
18008
(doi: 10.1021/ja1080025)
