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  • Currently displaying 15721 - 15740 of 29877 publications
Author(s)
Publication title
Journal Name
Publication year
Structure and properties of Ne n +; clusters from a diatomics-in-molecules approach
FY NAUMKIN, DJ WALES
Molecular Physics
(2010)
93
Efficient schemes to compute diffusive barrier crossing rates
MJ RUIZ-MONTERO, D FRENKEL, JJ BREY
Molecular Physics
(2010)
90
An ab initio study of anharmonicity and matrix effects on the hydrogen-bonded BrH:NH3 complex
BJE DEL BENE MEREDITH J. T. JORDAN, PMWGAAD BUCKINGHAM
Molecular Physics
(2010)
92
Nuclear magnetic shielding surfaces for CH3 F, CH3 Cl, and CH3 Br
BADBARM OLEGARIO
Molecular Physics
(2010)
92
Atomistic simulation of the stretching of nanoscale metal wires
BGM FINBOW, RML-BAIR MCDONALD
Molecular Physics
(2010)
92
A density functional water dimer potential surface
BDKW MOK, NCHARD AMOS
Molecular Physics
(2010)
92
A study of sulphur-containing molecules using Hartree-Fock, MP2 and DFT (hybrid) methodologies
BJA ALTMANN, NCHAVE INGAMELLS
Molecular Physics
(2010)
92
Transferability of topologically partitioned polarizabilities: The case of n-alkanes
AJ STONE, C HÄTTIG, G JANSEN, JG ÀNGYÀ
Molecular Physics
(2010)
89
Structure, rearrangements and evaporation of rotating atomic clusters
MA MILLER, DJ WALES
Molecular Physics
(2010)
89
Solar hydrogen evolution with hydrogenases: From natural to hybrid systems
E Reisner
European Journal of Inorganic Chemistry
(2010)
2011
Self-Assembly of Lamellar Microphases in Linear Gradient Copolymer Melts
NB Tito, ST Milner, JEG Lipson
Macromolecules
(2010)
43
Phase Behavior of Heptanamide Adsorbed on a Graphite Substrate
T Bhinde, TK Phillips, SM Clarke, T Arnold, JE Parker
Langmuir : the ACS journal of surfaces and colloids
(2010)
27
Detecting the "afterglow" of 13C NMR in proteins using multiple receivers
Ē Kupče, LE Kay, R Freeman
J Am Chem Soc
(2010)
132
Silaindacenodithiophene semiconducting polymers for efficient solar cells and high-mobility ambipolar transistors
RS Ashraf, Z Chen, DS Leem, H Bronstein, W Zhang, B Schroeder, Y Geerts, J Smith, S Watkins, TD Anthopoulos, H Sirringhaus, JC de Mello, M Heeney, I McCulloch
Chemistry of Materials
(2010)
23
Phase diagrams and surface properties of modified water models
J Alejandre, RM Lynden-bell
Molecular Physics
(2010)
105
Unveiling the neuromorphological space.
LDF Costa, K Zawadzki, M Miazaki, MP Viana, SN Taraskin
Front Comput Neurosci
(2010)
4
Symmetry pathways in solid-state NMR
PJ Grandinetti, JT Ash, NM Trease
Prog Nucl Magn Reson Spectrosc
(2010)
59
An isoprene mechanism intercomparison
AT Archibald, ME Jenkin, DE Shallcross
Atmospheric Environment
(2010)
44
The electrochemistry of lithium in ionic liquid/organic diluent mixtures
GH Lane, AS Best, DR MacFarlane, M Forsyth, PM Bayley, AF Hollenkamp
Electrochimica Acta
(2010)
55
Host-guest-driven copolymerization of tetraphosphonate cavitands.
F Tancini, RM Yebeutchou, L Pirondini, R De Zorzi, S Geremia, OA Scherman, E Dalcanale
Chemistry
(2010)
16