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- Currently displaying 23301 - 23320 of 30391 publications
The transcorrelated method for accurate correlation energies using gaussian-type functions: examples on He, H-2, LiH and H2O (Reprinted from Molecular Physics, vol 23, pg 1-27, 1972)
Molecular Physics
(2002)
100
77
(doi: 10.1080/00268970110088929)
Comment: A molecular dynamics method for simulations in the canonical ensemble
Molecular Physics
(2002)
100
189
(doi: 10.1080/00268970110089117)
The hard ellipsoid-of-revolution fluid. I. Monte Carlo simulations - Comment
Molecular Physics
(2002)
100
201
(doi: 10.1080/00268970110088992)
A rigid sphere model for the melting of argon - Comment
Molecular Physics
(2002)
100
21
(doi: 10.1080/00268970110088703)
Synthesis, structures and coordination behaviour of [As(NR)3]3- trianions
Journal of the Chemical Society, Dalton Transactions
(2002)
343
(doi: 10.1039/b106913f)
Double-quantum-filtered nuclear magnetic resonance spectroscopy applied to quadrupolar nuclei in solids
The Journal of Chemical Physics
(2002)
116
710
(doi: 10.1063/1.1425831)
Nitrone dipolar cycloaddition routes to piperidines and indolizidines
Journal of the Chemical Society Perkin Transactions 1
(2002)
2
1494
(doi: 10.1039/b200328g)
Disorder-induced zero-energy spectral singularity for random matrices with correlations
Physical Review B Condensed Matter and Materials Physics
(2002)
65
1
(doi: 10.1103/PhysRevB.65.052201)
A peptide that binds and stabilizes p53 core domain:: Chaperone strategy for rescue of oncogenic mutants
Proceedings of the National Academy of Sciences of the United States of America
(2002)
99
937
(doi: 10.1073/pnas.241629998)
Microembossing of elastomeric triblock copolymers
Advanced Materials
(2002)
14
47
The crystalline structures of the even alkanes hexane, octane, decane, dodecane and tetradecane monolayers adsorbed on graphite at submonolayer coverages and from the liquid
Physical Chemistry Chemical Physics
(2002)
4
345
(doi: 10.1039/b108190j)
Synthesis of the 3R2 polytype of a hydrotalcite-like mineral
Journal of Materials Chemistry
(2002)
12
153
(doi: 10.1039/b110715c)
Magnetism and Structural Chemistry of the n = 1 Ruddlesden−Popper Phases La4LiMnO8 and La3SrLiMnO8
Journal of the American Chemical Society
(2002)
124
620
(doi: 10.1021/ja012023z)
Loss of a metal-binding site in gelsolin leads to familial amyloidosis–Finnish type
Nature Structural Biology
(2002)
9
112
(doi: 10.1038/nsb745)
High-throughput crystallography for lead discovery in drug design.
Nature reviews. Drug discovery
(2002)
1
45
(doi: 10.1038/nrd706)
A study of the known and hypothetical crystal structures of pyridine : why are there four molecules in the asymmetric unit cell?
CrystEngComm
(2002)
4
348
(doi: 10.1039/b202084j)
Theoretical determination of the vibrational levels of NH3+ with MULTIMODE
Phys. Chem. Chem. Phys.
(2002)
4
4087
(doi: 10.1039/b203364j)
Oxygen scavenging by lithium zincates:: the synthesis, structural characterisation and derivatisation of [Ph(2-C5H4N)N]2ZnRLi•nthf (R = But, Bun; n = 1, 2)
Dalton Transactions
(2002)
3129
(doi: 10.1039/b203451d)