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- Currently displaying 27721 - 27740 of 29773 publications
THE PREDICTION OF MICROWAVE AND INFRARED-SPECTRA OF TRIATOMIC-MOLECULES
– ABSTR PAP AM CHEM S
(1988)
196,
50
THEORETICAL-STUDIES OF ALDOL STEREOSELECTIVITY - THE DEVELOPMENT OF A FORCE-FIELD MODEL FOR ENOL BORINATES AND THE INVESTIGATION OF CHIRAL ENOLATE PI-FACE SELECTIVITY
– ABSTR PAP AM CHEM S
(1988)
196,
352
Longitudinal NMR relaxation of 27Al nuclei in zeolites
– Chemical Physics Letters
(1988)
150,
189
(doi: 10.1016/0009-2614(88)80025-3)
RATE CONSTANTS FOR THE REACTIONS CN(V=0), CN(V=1)+H2, D2-]HCN, DCN+H, D BETWEEN 295-K AND 768-K, AND COMPARISONS WITH TRANSITION-STATE THEORY CALCULATIONS
– Chemical Physics Letters
(1988)
149,
565
(doi: 10.1016/0009-2614(88)80384-1)
Structure and properties of rare earth overlayers and ultra-thin alloy films on single crystal copper: Nd on Cu(111)
– Surface Science
(1988)
203,
307
(doi: 10.1016/0039-6028(88)90085-4)
Molecular model for aqueous ferrous-ferric electron transfer
– The Journal of Chemical Physics
(1988)
89,
3248
(doi: 10.1063/1.454929)
A VARIATIONAL METHOD FOR THE DETERMINATION OF THE VIBRATIONAL (J=0) ENERGY-LEVELS OF ACETYLENE, USING A HAMILTONIAN IN INTERNAL COORDINATES
– Computer Physics Communications
(1988)
51,
49
(doi: 10.1016/0010-4655(88)90061-6)
Ab initio quantum chemistry on microcomputers
– Computational and Theoretical Chemistry
(1988)
170,
197
(doi: 10.1016/0166-1280(88)80063-0)
The accurate calculation of molecular properties by ab initio methods
– J CHEM SOC FARAD T 2
(1988)
84,
1247
(doi: 10.1039/f29888401247)
Determination of an Adlayer Bonding Transition by Surface Extended X-Ray-Absorption Fine-Structure Spectroscopy: Cesium Adsorbed on Ag {111}
– Physical review letters
(1988)
61,
1112
(doi: 10.1103/PhysRevLett.61.1112)
Solid-state NMR studies of the geometry of brønsted acid sites in zeolitic catalysts
– Chemical Physics Letters
(1988)
149,
355
(doi: 10.1016/0009-2614(88)85107-8)
Experimental evidence for an inorganic molecular glass.
– Physical review letters
(1988)
61,
974
(doi: 10.1103/PhysRevLett.61.974)
Mo/ller–Plesset third order calculations with large basis sets
– The Journal of Chemical Physics
(1988)
89,
2107
(doi: 10.1063/1.455107)
A CELLULAR LIGAND-FIELD MODEL FOR L-L SPECTRAL INTENSITIES .2. APPLICATIONS WITHIN THE D-BLOCK
– Molecular Physics
(1988)
64,
793
(doi: 10.1080/00268978800100563)
A cellular ligand-field model for' l-l’ spectral intensities III. Correlations of parameters with structure and bonding
– Molecular Physics
(1988)
64,
825
(doi: 10.1080/00268978800100573)
Recent Advances in Solid-State NMR of Zeolites
– Annual Review of Materials Research
(1988)
18,
189
Optimization of a distributed Gaussian basis set using simulated annealing: Application to the adiabatic dynamics of the solvated electron
– The Journal of Chemical Physics
(1988)
89,
1592
(doi: 10.1063/1.455156)
Hydration of tricalcium silicate with D2O
– Journal of Materials Science Letters
(1988)
7,
861
(doi: 10.1007/BF00723787)
TYROSYL-TRANSFER RNA-SYNTHETASE ACTS AS AN ASYMMETRIC DIMER IN CHARGING TRANSFER-RNA - A RATIONALE FOR HALF-OF-THE-SITES ACTIVITY
– BIOCHEMISTRY
(1988)
27,
5525
(doi: 10.1021/bi00415a021)