Propagators in Quantum Chemistry, 2nd Edition

Index

2p — 2h-corrections, 200

-ordering, 94, 237

g-tensor, 171

Absorption coefficient, 83

Adiabatic switching, 208

Angular momentum, 18, 90

Angular momentum, spin, 37

Angular momentum, 18, 35, 38, 51, 54, 85, 98, 105, 110, 159

Angular momentum, spin, 18, 52, 78, 97

Angular momentum, spin, 18, 37, 38, 40, 50, 54, 70

Anticommutation, 15, 16, 26, 51, 61, 126, 155, 168, 237

Antisymmetrized geminal power, 64

Atomic central field, 37, 55

Average of configuration, 47, 48

Avogadro’s number, 103

Bias operator, 207

Bohr magneton, 78, 101

Bohr radius, 103

Bohr-Sommerfeld quantization condition, 35

Bond order, 14, 15, 166, 167, 169

Born approximation, zeroth-order, 152

Boson-like operator, 22, 197

Bosons, 258

Boundary conditions, 3, 4, 6, 31, 33, 85

Branch cut, 33

Carbon, 43, 57, 59

Carbon Monoxide, CO, 148

Cauchy’s integral, 214

Cauchy’s theorem, 214

Cauchy-Riemann equations, 212

Charge density, 168

Charge density operator, 168

Charge density, 16, 82, 95, 169

Charge density operator, 169

Charge density operator, 16, 168

Chemical potential, 27, 29, 36, 48, 235, 260

Chemical reactions, 251

Chemical reactions, Reaction rates, 207

Chemical shift, 106, 117

Circular dichroism, 88

CNDO approximation, 168, 169

CNDO approximation, 166, 168, 170, 171

Complex E-plane, 9–11, 29, 204

Complex rotatory power, 90

Complex rotatory power, 89

Complex spectra, 55

Configurations, 40, 47, 49, 51, 57, 66, 158