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- Currently displaying 18801 - 18820 of 29386 publications
A reaction surface Hamiltonian study of malonaldehyde
– The Journal of Chemical Physics
(2006)
125,
084313
(doi: 10.1063/1.2338891)
Hydrogenation of aromatic ketones, aldehydes, and epoxides with hydrogen and Pd(0)EnCat (TM) 30NP
– Beilstein J Org Chem
(2006)
2,
15
(doi: 10.1186/1860-5397-2-15)
Molecular Size Evolution of Oligomers in Organic Aerosols Collected in Urban Atmospheres and Generated in a Smog Chamber
– Environmental Science & Technology
(2006)
40,
5917
(doi: 10.1021/es0525760)
Polymorphism of Scyllo-Inositol: Joining Crystal Structure Prediction with Experiment to Elucidate the Structures of Two Polymorphs
– Crystal Growth and Design
(2006)
6,
2301
(doi: 10.1021/cg060179a)
Convergent approaches for the synthesis of the antitumoral peptide, Kahalalide F. study of orthogonal protecting groups
– J Org Chem
(2006)
71,
7196
(doi: 10.1021/jo060976f)
“Stick and slide” ferrofluidic droplets on superhydrophobic surfaces
– Applied Physics Letters
(2006)
89,
081911
(doi: 10.1063/1.2336729)
DIODE-LASER SPECTROSCOPY OF THE 7I-6H AND 7H-6G TRANSITIONS IN H-2
– Molecular Physics
(2006)
81,
1435
(doi: 10.1080/00268979400100981)
Far infra-red laser magnetic resonance (LMR) spectra of SH and SD, (x2Π3/2)
– Molecular Physics
(2006)
36,
1005
(doi: 10.1080/00268977800102121)
A new basis set for molecular wavefunctions
– Molecular Physics
(2006)
26,
715
(doi: 10.1080/00268977300102031)
Theoretical studies of the collision-induced Raman spectrum of carbon dioxide
– Molecular Physics
(2006)
39,
1519
(doi: 10.1080/00268978000101251)
Reorientational correlation functions for computer-simulated liquids of tetrahedral molecules
– Molecular Physics
(2006)
43,
1429
(doi: 10.1080/00268978100102181)
Reorientation of N2adsorbed on graphite in various computer simulated phases
– Molecular Physics
(2006)
54,
183
(doi: 10.1080/00268978500100151)
Validity of the high temperature approximation and influence of polydispersity on the phase separation in charged colloidal dispersions
– Molecular Physics
(2006)
56,
385
(doi: 10.1080/00268978500102391)
Intermolecular perturbation theory
– Molecular Physics
(2006)
53,
107
(doi: 10.1080/00268978400102161)
Electric field-gradient-induced birefringence in N2, C2H6, C3H6, Cl2, N2O and CH3F
– Molecular Physics
(2006)
49,
703
(doi: 10.1080/00268978300101481)
Ligand Field Effects on the Aqueous Ru(III)/Ru(II) Redox Couple from an All-Atom Density Functional Theory Perspective
– J Chem Theory Comput
(2006)
2,
1403
(doi: 10.1021/ct600169e)
The long range model of intermolecular forces
– Molecular Physics
(2006)
50,
1349
(doi: 10.1080/00268978300103091)
A variational method for the calculation of rovibrational levels of any triatomic molecule
– Molecular Physics
(2006)
49,
745
(doi: 10.1080/00268978300101521)
Chemical shift calculations for carbon, nitrogen and oxygen in simple molecules
– Molecular Physics
(2006)
19,
371
(doi: 10.1080/00268977000101371)