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  • Currently displaying 18101 - 18120 of 29307 publications
Author(s)
Publication title
Journal Name
Publication year
Vibrational energy levels with arbitrary potentials using the Eckart-Watson Hamiltonians and the discrete variable representation
E Mátyus, G Czakó, BT Sutcliffe, AG Császár
The Journal of chemical physics
(2007)
127
Crystal and Molecular Structure of trans-1,2-bis(2-benzothiazolyl)ethene
P Kaushik, D-K Bučar, LR MacGillivray
Journal of Chemical Crystallography
(2007)
37
Can crystal structure prediction predict whether a salt or a cocrystal will be formed?
KE Hejczyk, GM Day, W Jones
Acta Crystallographica Section A: Foundations and advances
(2007)
63
Fluctuation-dissipation ratios in the dynamics of self-assembly.
RL Jack, MF Hagan, D Chandler
Physical review. E, Statistical, nonlinear, and soft matter physics
(2007)
76
An overview of snow photochemistry: Evidence, mechanisms and impacts
AM Grannas, AE Jones, J Dibb, M Ammann, C Anastasio, HJ Beine, M Bergin, J Bottenheim, CS Boxe, G Carver, G Chen, JH Crawford, F Dominé, MM Frey, MI Guzmán, DE Heard, D Helmig, MR Hoffmann, RE Honrath, LG Huey, M Hutterli, HW Jacobi, P Klán, B Lefer, J McConnell, J Plane, R Sander, J Savarino, PB Shepson, WR Simpson, JR Sodeau, R von Glasow, R Weller, EW Wolff, T Zhu
Atmospheric Chemistry and Physics
(2007)
7
Predicting and engineering inclusion frameworks
AJC Cabeza, GM Day, WDS Motherwell, W Jones
Acta Crystallographica Section A Foundations of Crystallography
(2007)
63
Can Marcus Theory Be Applied to Redox Processes in Ionic Liquids? A Comparative Simulation Study of Dimethylimidazolium Liquids and Acetonitrile
RM Lynden-Bell
The journal of physical chemistry. B
(2007)
111
Optical Absorption of a Green Fluorescent Protein Variant: Environment Effects in a Density Functional Study
C Camilloni, D Provasi, G Tiana, RA Broglia
J Phys Chem B
(2007)
111
A sequential enantioselective, organocatalytic route to chiral 1,2-oxazines and chiral pyridazines.
S Kumarn, AJ Oelke, DM Shaw, DA Longbottom, SV Ley
Organic and Biomolecular Chemistry
(2007)
5
Multimodel projections of stratospheric ozone in the 21st century
V Eyring, DW Waugh, GE Bodeker, E Cordero, H Akiyoshi, J Austin, SR Beagley, BA Boville, P Braesicke, C Brühl, N Butchart, MP Chipperfield, M Dameris, R Deckert, M Deushi, SM Frith, RR Garcia, A Gettelman, MA Giorgetta, DE Kinnison, E Mancini, E Manzini, DR Marsh, S Matthes, T Nagashima, PA Newman, JE Nielsen, S Pawson, G Pitari, DA Plummer, E Rozanov, M Schraner, JF Scinocca, K Semeniuk, TG Shepherd, K Shibata, B Steil, RS Stolarski, W Tian, M Yoshiki
Journal of Geophysical Research Atmospheres
(2007)
112
Short, Facile, and High‐Yielding Synthesis of Extremely Efficient Pincer‐Type Suzuki Catalysts Bearing Aminophosphine Substituents
JL Bolliger, O Blacque, CM Frech
Angew Chem Int Ed Engl
(2007)
46
Natural Products as an Inspiration for the Discovery of New High‐Throughput Chemical Synthesis Tools
SV Ley, IR Baxendale, DA Longbottom, RM Myers
(2007)
2
COLL 215-Switching on the dipole: A new principle for the self-assembly of asymmetric monomers on metal surfaces
OPH Vaughan, A Alavi, FJ Williams, RM Lambert
ABSTR PAP AM CHEM S
(2007)
234
ORGN 254-Studies toward the synthesis of neolaulimalide and laulimalide
I Paterson, JK Hutchinson, A Longstaff
ABSTR PAP AM CHEM S
(2007)
234
ENVR 154-Photoenhanced HONO production on atmospherically relevant mineral surfaces
RJ Gustafsson, A Orlov, PT Griffiths, RA Cox, RM Lambert
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
PHYS 342-Heterogeneous asymmetric hydrogenation of C=C bonds
DJ Watson, RBR John-Jesudason, AI McIntosh, DC Madden, JW Burton, RM Lambert
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
ORGN 261-Studies toward the total synthesis of the brasilinolides
I Paterson, PM Burton, F Muehlthau
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
Exploring energy landscapes with explicit and implicit water
DJ Wales
ABSTR PAP AM CHEM S
(2007)
234
PHYS 97-Density functional based molecular dynamics simulation of the aqueous hydroxyl and thiyl radical
M Sprik, C Adriaanse, M Sulpizi, J VandeVondele
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234
PHYS 31-Redox free energies and one-electron energy levels from density functional theory based molecular dynamics
M Sprik, R Ayala, J VandeVondele
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2007)
234