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- Currently displaying 26621 - 26640 of 29213 publications
On the anisotropy of diffusion in nematic liquid crystals:Test of a modified affine transformation model via molecular dynamics
– Molecular Physics
(1991)
74,
765
(doi: 10.1080/00268979100102561)
PLASMA SIMULATIONS USING THE CAR-PARRINELLO METHOD
– COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205,
467
Research note:Diode laser infrared spectroscopy of jet-cooled hexacarbonyls of chromium, molybdenum, and tungsten
– Molecular Physics
(1991)
74,
919
(doi: 10.1080/00268979100102691)
THE CALCULATION OF INTERMOLECULAR POTENTIALS
– ADVANCES IN BIOMOLECULAR SIMULATIONS
(1991)
239,
3
Structure–activity studies on amides inhibiting photosystem II
– JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
(1991)
1625
(doi: 10.1039/p29910001625)
Assessment of a method for the measurement of long-range heteronuclear coupling constants
– Journal of Magnetic Resonance (1969)
(1991)
93,
533
(doi: 10.1016/0022-2364(91)90081-4)
Lithiations of mercaptoamines containing NC(S)NH–,–NHC(S)S– and –NHC(S)NH– units: syntheses, crystal structures and model molecular-orbital calculations
– J. Chem. Soc., Dalton Trans.
(1991)
765
(doi: 10.1039/dt9910000765)
The onset of disorder on a surface with a step
– Molecular Physics
(1991)
73,
1401
(doi: 10.1080/00268979100102001)
Liquides, cristallisation et transition vitreuse = Liquids, freezing and glass transition
– Proceedings of the 51st session of the École d’été de physique théorique, Les Houches, 1989 and also forming a NATO Advanced Study Institute
(1991)
2 vols,
STRUCTURE AND DYNAMICS OF REACTIVE TRANSITION-STATES - GENERAL DISCUSSION
– FARADAY DISCUSSIONS
(1991)
91,
465
(doi: 10.1039/dc9919100465)
A STUDY ON THE REACTION-MECHANISM OF METHANOL CONVERSION TO HYDROCARBONS BY SOLID-STATE NMR AND GAS-CHROMATOGRAPHY ON A SAPO-34 CATALYST
– CATALYTIC SCIENCE AND TECHNOLOGY, VOL 1
(1991)
1,
79
The synthesis of (Z)-penta-2,4-dien-1-ol and substituted (E)-pentadienols by the stereochemically controlled Horner–Wittig reaction
– J CHEM SOC PERK T 1
(1991)
1485
(doi: 10.1039/p19910001485)
Investigation of the SMSI phenomenon with TiO2/Ru/SiO2 model-dispersed catalysts
– Journal of Catalysis
(1991)
129,
486
(doi: 10.1016/0021-9517(91)90051-5)
A VECTORISABLE ALGORITHM FOR CALCULATING 3-BODY INTERACTIONS
– Computer Physics Communications
(1991)
62,
179
(doi: 10.1016/0010-4655(91)90093-z)
QUANTUM SIMULATION USING PATH-INTEGRALS
– COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205,
305
27Al solid-state NMR spectra of ultrastable zeolite Y with fast magic-angle spinning and 1H-27Al cross-polarization
– J. Chem. Soc., Chem. Commun.
(1991)
1121
(doi: 10.1039/C39910001121)
AN INTRODUCTION TO MOLECULAR-DYNAMICS, WITH APPLICATIONS TO THE GLASS-TRANSITION
– COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205,
3
BASIC CONCEPTS AND TOOLS OF LIQUID-STATE THEORY
– HYDROGEN-BONDED LIQUIDS
(1991)
329,
5
[6] Protein engineering in analysis of protein folding pathways and stability
– Methods Enzymol
(1991)
202,
82
(doi: 10.1016/0076-6879(91)02008-w)
Theoretical assignment of the visible spectrum of singlet methylene
– The Journal of Chemical Physics
(1991)
94,
118
(doi: 10.1063/1.460385)