Physical Chemistry Third Edition

902 21 The Electronic Structure of Polyatomic Molecules C`hD`hTd,Oh,Ci,C 1 ,Cs,Dnd,Dnh,Dn,Cnh,Cnv,Cn,Sn Linear molecules Special ...

21.9 Groups of Symmetry Operators 903 molecule will leave the dipole moment unchanged, since it can at most exchange nuclei of t ...

904 21 The Electronic Structure of Polyatomic Molecules 21.61Tell which of the following molecules and ions will have nonzero di ...

21.10 More Advanced Treatments of Molecular Electronic Structure. Computational Chemistry 905 and that do not necessarily have c ...

906 21 The Electronic Structure of Polyatomic Molecules An approximation calledzero differential overlapis invoked to set some o ...

21.10 More Advanced Treatments of Molecular Electronic Structure. Computational Chemistry 907 Table 21.5 Comparison of Semiempir ...

908 21 The Electronic Structure of Polyatomic Molecules functions that simulate Slater-type orbitals. For example, in the STO-3G ...

21.10 More Advanced Treatments of Molecular Electronic Structure. Computational Chemistry 909 of Chapter 16. exp(̂T) 1 +̂T+ 1 2 ...

910 21 The Electronic Structure of Polyatomic Molecules years ago. The following is a list of some programs that were available ...

21.10 More Advanced Treatments of Molecular Electronic Structure. Computational Chemistry 911 into the CAChe package of programs ...

912 21 The Electronic Structure of Polyatomic Molecules 21.71Use a computer program such as CAChe or Spartan to find the semiemp ...

21.10 More Advanced Treatments of Molecular Electronic Structure. Computational Chemistry 913 Include a specification of the mol ...

914 21 The Electronic Structure of Polyatomic Molecules 21.88Using one of the available computational chemistry programs, carry ...

22 Translational, Rotational, and Vibrational States of Atoms and Molecules PRINCIPAL FACTS AND IDEAS Atoms have translational ...

916 22 Translational, Rotational, and Vibrational States of Atoms and Molecules 22.1 The Translational States of Atoms The energ ...

22.1 The Translational States of Atoms 917 EXAMPLE22.1 The energy difference between the ground state and first excited electron ...

918 22 Translational, Rotational, and Vibrational States of Atoms and Molecules Solution a. 3 kBT 2  3 2 (1. 3807 × 10 −^23 JK− ...

22.2 The Nonelectronic States of Diatomic Molecules 919 b. Find the change in energy if one of the translational quantum numbers ...

920 22 Translational, Rotational, and Vibrational States of Atoms and Molecules Appendix E and was applied to the hydrogen atom ...

22.2 The Nonelectronic States of Diatomic Molecules 921 The Rigid Rotor The rigid rotor is a model system that consists of two n ...