Prediction of internuclear separations and force constants in diatomic molecules

Transactions of the Faraday Society ◽

10.1039/tf9615702099 ◽

1961 ◽

Vol 57 ◽

pp. 2099 ◽

Cited By ~ 1

Author(s):

R. R. Getty ◽

J. C. Polanyi

Keyword(s):

Diatomic Molecules ◽

Force Constants

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An attempt to decompose the force constants for some diatomic molecules by the derivatives of the electronic kinetic energy

Theoretical Chemistry Accounts ◽

10.1007/s00214-005-0006-z ◽

2005 ◽

Vol 115 (4) ◽

pp. 276-280 ◽

Cited By ~ 1

Author(s):

Ken Sakata

Keyword(s):

Kinetic Energy ◽

Diatomic Molecules ◽

Force Constants ◽

Derivatives Of

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Force Constants of Diatomic Molecules. I. A General Semitheoretical Approach

The Journal of Chemical Physics ◽

10.1063/1.1840571 ◽

1967 ◽

Vol 46 (11) ◽

pp. 4474-4481 ◽

Cited By ~ 13

Author(s):

Philip Empedocles

Keyword(s):

Diatomic Molecules ◽

Force Constants

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A simple relation between the internuclear distances and force constants of diatomic molecules

The Journal of Physical Chemistry ◽

10.1021/j100483a026 ◽

1979 ◽

Vol 83 (20) ◽

pp. 2677-2682 ◽

Cited By ~ 16

Author(s):

Roman F. Nalewajski

Keyword(s):

Diatomic Molecules ◽

Simple Relation ◽

Force Constants ◽

Internuclear Distances

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Use of the approximation of the morse potential for quantum calculations of force constants of diatomic molecules

Journal of Applied Spectroscopy ◽

10.1007/bf00604778 ◽

1978 ◽

Vol 29 (5) ◽

pp. 1401-1402

Author(s):

V. I. Perevozchikov ◽

L. A. Gribov

Keyword(s):

Morse Potential ◽

Diatomic Molecules ◽

Force Constants ◽

Quantum Calculations

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On evaluating force constants from LCAO—MO—SCF electronic charge densities for diatomic molecules

The Journal of Chemical Physics ◽

10.1063/1.1678934 ◽

1973 ◽

Vol 58 (1) ◽

pp. 381-383 ◽

Cited By ~ 21

Author(s):

Alfred B. Anderson

Keyword(s):

Diatomic Molecules ◽

Force Constants ◽

Electronic Charge ◽

Charge Densities ◽

Lcao Mo

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The Relation Between Internuclear Distances and the Force Constants of Diatomic Molecules

Physical Review ◽

10.1103/physrev.48.284.2 ◽

1935 ◽

Vol 48 (3) ◽

pp. 284-285 ◽

Cited By ~ 30

Author(s):

Richard M. Badger

Keyword(s):

Diatomic Molecules ◽

Force Constants ◽

Internuclear Distances

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A novel method for the calculation of bond stretching force constants of diatomic molecules

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2015.10.030 ◽

2016 ◽

Vol 154 ◽

pp. 103-107 ◽

Cited By ~ 9

Author(s):

Savaş Kaya ◽

Cemal Kaya ◽

I.B. Obot ◽

Nazmul Islam

Keyword(s):

Diatomic Molecules ◽

Force Constants ◽

Bond Stretching ◽

Novel Method

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Force Constants in Diatomic Molecules, from Charge Densities

Electron and Magnetization Densities in Molecules and Crystals ◽

10.1007/978-1-4684-1018-1_31 ◽

1980 ◽

pp. 569-570

Author(s):

Pierre Becker

Keyword(s):

Diatomic Molecules ◽

Force Constants ◽

Charge Densities

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Evaluation of the force constants of diatomic molecules in the first order of perturbation theory

Theoretical and Experimental Chemistry ◽

10.1007/bf00524875 ◽

1976 ◽

Vol 11 (5) ◽

pp. 555-558

Author(s):

V. E. Sorochinskaya ◽

V. P. Morozov

Keyword(s):

Perturbation Theory ◽

Diatomic Molecules ◽

Force Constants ◽

First Order

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Bond Energy in Diatomic Molecules from the Force Constants, Nuclear Distances, and Classical Model Theory.

The Journal of Physical Chemistry ◽

10.1021/j150452a005 ◽

1947 ◽

Vol 51 (2) ◽

pp. 407-414

Author(s):

Melvin A. Cook

Keyword(s):

Model Theory ◽

Bond Energy ◽

Diatomic Molecules ◽

Classical Model ◽

Force Constants

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