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  • Currently displaying 28461 - 28480 of 30304 publications
Author(s)
Publication title
Journal Name
Publication year
Density functional theory of soft sphere freezing
JL Barrat, JP Hansen, G Pastore, EM Waisman
The Journal of Chemical Physics
(1987)
86
INFRARED-LASER SPECTROSCOPY OF THE FUNDAMENTAL-BAND OF A3-PI CO
PB Davies, PA Martin
Chemical Physics Letters
(1987)
136
VELOCITY AUTOCORRELATION FUNCTIONS IN A 2D LATTICE LORENTZ GAS - COMPARISON OF THEORY AND COMPUTER-SIMULATION
D Frenkel
Physics Letters A
(1987)
121
Factorization of the Triplet Direct Correlation Function in Dense Fluids
JL Barrat, JP Hansen, G Pastore
Physical Review Letters
(1987)
58
Comment on: ‘‘Magnetic birefringence measurement in hydrogen and deuterium gases’’
AD Buckingham, JH Williams
The Journal of Chemical Physics
(1987)
86
PRESSURE-DEPENDENCE OF ETHYLENE OXIDATION-KINETICS AND THE EFFECTS OF ADDED CO2 AND CS - A STUDY ON AG(111) AND AG/ALPHA-AL2O3 CATALYSTS
SA Tan, RB Grant, RM Lambert
Applied Catalysis
(1987)
31
THE ANALYTIC EVALUATION OF 2ND-ORDER MOLLER-PLESSET (MP2) DIPOLE-MOMENT DERIVATIVES
ED Simandiras, RD Amos, NC Handy
Chemical Physics
(1987)
114
ISOLATION AND SOLUTION STRUCTURES OF (PHCH2NLICH2CH2NME2)N AND OF THE TOTALLY RIGID DILITHIUM COMPOUND, (ORTHO-LIC6H4CH2NLICH2CH2NME2)N - EVIDENCE FOR LI ... ORTHO-HC INTERACTIONS
D Barr, R Snaith, DS Wright, RE Mulvey, K Jeffrey, D Reed
Journal of Organometallic Chemistry
(1987)
325
Orientational order and solid-liquid coexistence in the two-dimensional Lennard-Jones system
C Udink, D Frenkel
Phys Rev B Condens Matter
(1987)
35
The derivation of vibration-rotation kinetic energy operators, in internal coordinates
NC Handy
Molecular Physics
(1987)
61
Phenylthioallyl and phenylthiovinyl phosphine oxides: synthesis of 1-phenylthiobutadienes and a three-component synthesis of ketones
JI Grayson, S Warren, AT Zaslona
Journal of the Chemical Society Perkin Transactions 1
(1987)
Observation of dynamical precursors of the isotropic-nematic transition by computer simulation
MP Allen, D Frenkel
Physical Review Letters
(1987)
58
Partial enthalpies and related quantities in mixtures from computer simulation
P Sindzingre, G Ciccotti, C Massobrio, D Frenkel
Chemical Physics Letters
(1987)
136
Studies on the biosynthesis of hydroxymellein using 17 O n.m.r. and 2 H n.m.r. spectroscopy to determine the origin of the C-4 hydroxy group
C Abell, AC Sutkowski, J Staunton
Chemical Communications
(1987)
Conversion of allosteric inhibition to activation in phosphofructokinase by protein engineering
FT Lau, AR Fersht
Nature
(1987)
326
Radiative decay lifetimes of CH−2
M Okumura, LI Yeh, D Normand, JJH van den Biesen, SW Bustamente, YT Lee, TJ Lee, NC Handy, HF Schaefer
The Journal of Chemical Physics
(1987)
86
Tying glutathione in knots
RP MASON, S NAYLOR, DH WILLIAMS, JKM SANDERS, G MONETI
Biochemical Society Transactions
(1987)
15
Biosynthesis of the indolizidine alkaloid, cyclizidine
FJ Leeper, P Padmanabhan, GW Kirby, GN Sheldrake
Chemical Communications
(1987)
A method for the determination of the eigenvalues of a very large matrix: Application to vibrational energy levels
S Carter, NC Handy
Computer Physics Communications
(1987)
44
ESR and X-ray diffraction studies of diacyl peroxides in urea and aluminosilicate hosts
MD Hollingsworth, KDM Harris, W Jones, JM Thomas
Journal of Inclusion Phenomena and Macrocyclic Chemistry
(1987)
5