Chapter
1.6. VARIATIONAL PRINCIPLES
Chapter 2 SCHRÖDINGER EQUATIONS FROM FISHER INFORMATION
2.1. FISHER INFORMATION FOR COMPLEX PROBABILITY AMPLITUDES
2.2. CONTINUITY EQUATIONS
2.3. STATIONARY SCHRÖDINGER EQUATION AS INFORMATION PRINCIPLE
2.4. TIME-DEPENDENT SCHRÖDINGER EQUATION FROM FISHER INFORMATION
2.5. INFORMATION PRINCIPLE GENERATING KOHN-SHAM EQUATIONS
2.6. INFORMATION PRINCIPLE FOR ADIABATIC SEPARATION OF ELECTRONS AND NUCLEI
2.7. SUPERPOSITION PRINCIPLES
Chapter 3 ELECTRON DISTRIBUTIONS AS CARRIERS OF INFORMATION IN MOLECULES
3.1. ALTERNATIVE LOCAL INFORMATION PROBES OF CHEMICAL BONDS
3.2. COMPARISON BETWEEN DENSITY-DIFFERENCE AND INFORMATION-DISTANCE DIAGRAMS
3.3. ENTROPY DISPLACEMENT DESCRIPTORS
3.4. ILLUSTRATIVE APPLICATION TO PROPELLANES
Chapter 4 BONDED ATOMS FROM INFORMATION THEORY
4.2. STOCKHOLDER ATOMS-IN-MOLECULES
4.3. INFORMATION-THEORETIC JUSTIFICATION
4.4. REPRESENTATIVE INFORMATION DENSITIES
Chapter 5 IMPORTANCE OF NON-ADDITIVE INFORMATION MEASURES
5.1. ALTERNATIVE RESOLUTIONS AND THEIR ADDITIVE AND NON-ADDITIVE COMPONENTS
5.2. ELECTRON LOCALIZATION FUNCTION
5.3. CONTRA-GRADIENCE CRITERION OF BOND LOCALIZATION
5.4. ILLUSTRATIVE APPLICATIONS
Chapter 6 ORBITAL COMMUNICATION THEORY OF THE CHEMICAL BOND
6.2. MOLECULAR INFORMATION SYSTEM IN ATOMIC ORBITAL RESOLUTION
6.3. COVALENT AND IONIC DESCRIPTORS OF CHEMICAL BONDS
6.4. TWO-ORBITAL MODEL OF CHEMICAL BOND
6.5. BOND-WEIGHTED CHANNELS AND WIBERG INDEX
6.6. ADDITIVE AND NON-ADDITIVE INFORMATION CHANNELS
6.7. MANY-ORBITAL PHENOMENA IN OCT
Appendix A INFORMATION CONTINUITY REVISITED
A.1. PROBABILITY, CURRENT AND INFORMATION DENSITIES
A.2. TIME-DEPENDENT PHEMOMENA AND STATIONARY ACTION PRINCIPLE
A.3. PROBABILITY CONTINUITY
A.4. STATIONARY-STATE RELATIONS
Appendix B CONDITIONAL PROBABILITIES FROM THE BOND-PROJECTED SUPERPOSITION PRINCIPLE
Appendix C MANY–STATE SUPERPOSITION PERSPECTIVE
Appendix D COUPLING APPROACH TO MANY–ORBITAL BOND INTERACTIONS
Information Origins of the Chemical Bond
( Chemistry Research and Applications )
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