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Record 1 of 18 |
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Author(s): Gatti, F; Iung, C |
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Title: Exact and constrained kinetic energy
operators in polyspherical coordinates |
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Source: JOURNAL OF THEORETICAL & COMPUTATIONAL
CHEMISTRY, 2 (4): 507-522 DEC 2003 |
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Record 2 of 18 |
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Author(s): Czinki, E; Csaszar, AG |
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Title: Conformers of gaseous proline |
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Source: CHEMISTRY-A EUROPEAN JOURNAL, 9 (4):
1008-1019 FEB 17 2003 |
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Record 3 of 18 |
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Author(s): Pajak, J; Ramaekers, R; Rospenk, M;
Alexandrov, V; Stepanian, S; Adamowicz, L; Maes, G |
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Title: Matrix-isolation FT-IR studies and
theoretical calculations of the vibrational properties of 4-methyl-2
'-hydroxy-4 '-ethyloxyazobenzene |
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Source: CHEMICAL PHYSICS, 286 (2-3): 193-204 JAN 15
2003 |
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Record 4 of 18 |
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Author(s): Lauvergnat, D; Nauts, A |
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Title: Exact numerical computation of a kinetic
energy operator in curvilinear coordinates |
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Source: JOURNAL OF CHEMICAL PHYSICS, 116 (19):
8560-8570 MAY 15 2002 |
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Record 5 of 18 |
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Author(s): Makarewicz, J; Skalozub, A |
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Title: The rovibrational Hamiltonian for
ammonia-like molecules |
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Source: SPECTROCHIMICA ACTA PART A-MOLECULAR AND
BIOMOLECULAR SPECTROSCOPY, 58 (4): 601-628 Sp. Iss. SI MAR 1 2002 |
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Record 6 of 18 |
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Author(s): Nyman, G; Yu, HG |
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Title: Quantum theory of bimolecular chemical
reactions |
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Source: REPORTS ON PROGRESS IN PHYSICS, 63 (7):
1001-1059 JUL 2000 |
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Record 7 of 18 |
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Author(s): Gatti, F |
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Title: Vector parametrization of the N-atom problem
in quantum mechanics. III. Separation into two subsystems: Application to NH3 |
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Source: JOURNAL OF CHEMICAL PHYSICS, 111 (16):
7225-7235 OCT 22 1999 |
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Record 8 of 18 |
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Author(s): Costa, LS; Neto, JJS |
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Title: A wave function expansion for the study of
tetra-atomic molecules in hyperspherical coordinate systems |
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Source: MOLECULAR PHYSICS, 97 (6): 725-730 SEP 20
1999 |
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Record 9 of 18 |
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Author(s): Iung, C; Gatti, F; Viel, A; Chapuisat, X |
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Title: Vector parametrization of the N-atom problem
in quantum mechanics with non-orthogonal coordinates |
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Source: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1
(15): 3377-3385 AUG 1 1999 |
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Record 10 of 18 |
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Author(s): Makarewicz, J; Skalozub, A |
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Title: Exact quantum mechanical kinetic energy
operator in valence coordinates for internal motions of a polyatomic molecule |
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Source: CHEMICAL PHYSICS LETTERS, 306 (5-6):
352-356 JUN 18 1999 |
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Record 11 of 18 |
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Author(s): Halonen, L |
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Title: Local mode vibrations in polyatomic
molecules |
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Source: ADVANCES IN CHEMICAL PHYSICS, VOL 104, 104:
41-179 1998 |
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Book series title: ADVANCES IN CHEMICAL PHYSICS |
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Record 12 of 18 |
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Author(s): Alexandrov, V; Stepanian, S; Adamowicz,
L |
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Title: Theoretical ab initio study of O-H
vibrational band in gas-phase glycine conformers |
|
Source: CHEMICAL PHYSICS LETTERS, 291 (1-2):
110-120 JUL 10 1998 |
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Record 13 of 18 |
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Author(s): Alvarez-Collado, JR |
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Title: On derivation of curvilinear ro-vibrational
quantum kinetic energy operator, for polyatomic molecules |
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Source: JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM,
433: 69-81 JUL 13 1998 |
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Record 14 of 18 |
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Author(s): Justum, Y; Menou, M; Nauts, A;
Chapuisat, X |
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Title: N-atom molecular systems: bunch of relative
position vectors, local coordinates and quantum-mechanical kinetic energy
operators |
|
Source: CHEMICAL PHYSICS, 223 (2-3): 211-237 NOV 1
1997 |
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Record 15 of 18 |
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Author(s): Chen, GJ; Liu, RZ |
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Title: A new method for the derivation of exact
vibration-rotational kinetic energy operator in internal coordinates |
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Source: SCIENCE IN CHINA SERIES B-CHEMISTRY, 40
(5): 517-522 OCT 1997 |
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Record 16 of 18 |
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Author(s): Csaszar, AG; Mills, IM |
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Title: Vibrational energy levels of water |
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Source: SPECTROCHIMICA ACTA PART A-MOLECULAR AND
BIOMOLECULAR SPECTROSCOPY, 53 (8): 1101-1122 JUL 30 1997 |
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Record 17 of 18 |
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Author(s): Allen, WD; Csaszar, AG; Szalay, V;
Mills, IM |
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Title: General derivative relations for anharmonic
force fields |
|
Source: MOLECULAR PHYSICS, 89 (5): 1213-1221 DEC 10
1996 |
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Record 18 of 18 |
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Author(s): CSASZAR, AG; HANDY, NC |
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Title: ON THE FORM OF THE EXACT QUANTUM-MECHANICAL
VIBRATIONAL KINETIC-ENERGY OPERATOR FOR PENTA-ATOMIC MOLECULES IN INTERNAL
COORDINATES |
|
Source: MOLECULAR PHYSICS, 86 (5): 959-979 DEC 10
1995 |