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- Currently displaying 26921 - 26940 of 29644 publications
Spin contamination in single-determinant wavefunctions
Chemical Physics Letters
(1991)
183
423
(doi: 10.1016/0009-2614(91)90405-X)
Some investigations of the MP2-R12 method
Theoretica Chimica Acta
(1991)
79
361
(doi: 10.1007/BF01114694)
An ultrahigh vacuum single crystal adsorption microcalorimeter
Review of Scientific Instruments
(1991)
62
2177
(doi: 10.1063/1.1142525)
Rotational relaxation in dense gases
Chemical Physics Letters
(1991)
183
316
(doi: 10.1016/0009-2614(91)80069-A)
THE PRODUCTION OF VIBRATIONALLY EXCITED NCO (X2-PI) IN THE REACTION BETWEEN CN RADICALS AND O2
Chemical Physics Letters
(1991)
183
254
(doi: 10.1016/0009-2614(91)80060-B)
Computer simulation of polymer-induced clustering of colloids.
Physical review letters
(1991)
67
1110
(doi: 10.1103/physrevlett.67.1110)
VARIATIONAL ROVIBRATIONAL STUDIES OF 3-ATOM AND 4-ATOM MOLECULES
ABSTR PAP AM CHEM S
(1991)
202
30
FREQUENCY-DEPENDENT HYPERPOLARIZABILITIES
ABSTR PAP AM CHEM S
(1991)
202
342
MODELING TRANSITION-STATES WITH FORCE-FIELDS - DEVELOPMENT OF THE BEST POSSIBLE PARAMETERS
ABSTR PAP AM CHEM S
(1991)
202
170
Vibration-rotation coordinates and kinetic energy operators for polyatomic molecules
Molecular Physics
(1991)
73
1183
(doi: 10.1080/00268979100101871)
A study of the ground electronic state of disulphane
Molecular Physics
(1991)
73
1209
(doi: 10.1080/00268979100101881)
The onset of disorder on a surface with a step
Molecular Physics
(1991)
73
1401
(doi: 10.1080/00268979100102001)
Isotope effects on the stability of the carbon monoxide-acetylene van der Waals molecule and the hydrogen fluoride dimer
Chemical Physics Letters
(1991)
182
551
(doi: 10.1016/0009-2614(91)90123-q)
SOLID-STATE AL-27 NMR-STUDIES OF ALPO4-8
Chemical Physics Letters
(1991)
182
531
(doi: 10.1016/0009-2614(91)90119-T)
CRYSTALLOGRAPHIC STUDIES OF INTRAMOLECULAR AND INTERMOLECULAR INTERACTIONS .7. CRYSTAL AND MOLECULAR-STRUCTURE OF THE COMPLEX OF ACRIDINE-PENTACHLOROPHENOL - H-BONDING EFFECT ON THE GEOMETRY OF THE PENTACHLOROPHENOL MOIETY
Journal of Molecular Structure
(1991)
248
331
(doi: 10.1016/0022-2860(91)80040-b)
Chemistry of insect antifeedants from azadirachta indica (part 8): Synthesis of hydroxydihydrofuran acetal fragments for biological evaluation and azadirachtin total synthesis studies.
Tetrahedron
(1991)
47
6813
Stereocontrolled synthesis of homoallylic amines using phosphine oxides and isoxazolines
Tetrahedron Letters
(1991)
32
4171
High-resolution image simulations of small metal particles
Proceedings of the Royal Society A
(1991)
434
279
(doi: 10.1098/rspa.1991.0093)
Origin of the first sharp diffraction peak in the structure factor of covalent glasses
Phys Rev Lett
(1991)
67
711
(doi: 10.1103/PhysRevLett.67.711)
Surface electrostatic interactions contribute little to stability of barnase
Journal of Molecular Biology
(1991)
220
779
(doi: 10.1016/0022-2836(91)90117-O)