Índice

additive;tex2html_html_special_mark_quot;separability

Size-Extensivity and Size-Consistency

Bartlett, R. J.

Introduction, Introduction, Introduction, Introduction, Size-Extensivity and Size-Consistency, A Variational Coupled-Cluster Theory?

Cambell-Baker-Hausdorff formula

seeHausdorff expansion

CCD

seecoupled-cluster;tex2html_html_special_mark_quot;doubles

CCSD

seecoupled-cluster;tex2html_html_special_mark_quot;singles and doubles

CEPA

seecoupled electron pair;tex2html_html_special_mark_quot;approximation

Cízek, J.

Introduction, Introduction, Introduction

cluster functions

(, )

configuration interaction

full

A Variational Coupled-Cluster Theory?

relationship to coupled-cluster

(, )

relationship to coupled-cluster

(, )

configuration;tex2html_html_special_mark_quot;interaction

size extensivity of

Size-Extensivity and Size-Consistency

connected operator

Algebraic Construction of the

contraction of operator pairs

Wick's Theorem, The Normal-Ordered Hamiltonian

coupled electron pair approximation

Other Cluster-Based Wavefunctions

coupled-cluster

doubles

Introduction, Introduction, Introduction, Introduction, Algebraic Construction of the

doubles

Introduction, Introduction, Introduction, Introduction, Algebraic Construction of the

doubles

Introduction, Introduction, Introduction, Introduction, Algebraic Construction of the

doubles

Introduction, Introduction, Introduction, Introduction, Algebraic Construction of the

doubles

Introduction, Introduction, Introduction, Introduction, Algebraic Construction of the

singles and doubles

Introduction, Introduction, Introduction

singles and doubles

Introduction, Introduction, Introduction

singles and doubles

Introduction, Introduction, Introduction

size-extensivity;tex2html_html_special_mark_quot;of

Size-Extensivity and Size-Consistency

coupled-pair many-electron;tex2html_html_special_mark_quot;theory

seecoupled-cluster doubles

CPMET

seecoupled-pair;tex2html_html_special_mark_quot;many-electron theory

diagrams

Introduction, Practical Coupled-Cluster Theory, Diagrammatic Construction of the

expectation-value coupled-cluster
method

A Variational Coupled-Cluster Theory?

exponential ansatz

The Cluster Operator, Construction of the General , Truncation of the CC , A Variational Coupled-Cluster Theory?

Hartree-Fock

energy

The Normal-Ordered Hamiltonian, The Normal-Ordered Hamiltonian, Usefulness of Second-Quantized Operators

energy

The Normal-Ordered Hamiltonian, The Normal-Ordered Hamiltonian, Usefulness of Second-Quantized Operators

energy

The Normal-Ordered Hamiltonian, The Normal-Ordered Hamiltonian, Usefulness of Second-Quantized Operators

theory

Size-Extensivity and Size-Consistency

wavefunctions

The Cluster Expansion

wavefunctions

The Cluster Expansion

wavefunctions

The Cluster Expansion

Hausdorff expansion

(, ), Algebraic Construction of the

Hoffman, M.

A Variational Coupled-Cluster Theory?

Hurley,;tex2html_html_special_mark_quot;A.

Introduction

IEPA

seeindependent;tex2html_html_special_mark_quot;electron pair approximation

independent electron pair;tex2html_html_special_mark_quot;approximation

Other Cluster-Based Wavefunctions

intermediate normalization

Construction of the General

Kutzelnigg, W.

A Variational Coupled-Cluster Theory?

Lee, T. J.

Introduction

linear ansatz

Relationship to Configuration Interaction

linked-diagram;tex2html_html_special_mark_quot;theorem

Algebraic Construction of the

many-body perturbation theory

Algebraic Construction of the

size-extensivity;tex2html_html_special_mark_quot;of

Size-Extensivity and Size-Consistency

MBPT

seemany-body;tex2html_html_special_mark_quot;perturbation theory

Meyer, W.

Other Cluster-Based Wavefunctions

Monkhorst, H.

Introduction

Nesbet, R. K.

Other Cluster-Based Wavefunctions

normal-ordering

(, ), The Normal-Ordered Hamiltonian, Algebraic Construction of the

definition of

Normal-Ordered Operators

oocupation-number formalism

seesecond-quantization

Paldus, J.

Introduction

particle-hole;tex2html_html_special_mark_quot;formalism

Normal-Ordered Operators

Pauli principle

The Cluster Operator

Pople, J. A.

Introduction, Size-Extensivity and Size-Consistency

Purvis, G. D., III

Introduction, Introduction

RHF

seeHartree-Fock,;tex2html_html_special_mark_quot;wavefunctions,;tex2html_html_special_mark_quot;spin-restricted

Schrödinger equation

Construction of the General , Construction of the General

Scuseria, G. E.

Introduction

second-quantization

Introduction, The Cluster Operator, Normal-Ordered Operators, The Normal-Ordered Hamiltonian, (, )

representation of operators in

(, )

representation of operators in

(, )

Simons, J.

A Variational Coupled-Cluster Theory?

Sinanoglu, O.

Other Cluster-Based Wavefunctions

size-consistency

(, )

size-extensivity

(, )

Slater's rules

Truncation of the CC

Taylor, P. R.

Introduction, Size-Extensivity and Size-Consistency

UCC

seeunitary;tex2html_html_special_mark_quot;coupled-cluster
method

UHF

seeHartree-Fock, wavefunctions,;tex2html_html_special_mark_quot;spin-unrestricted

unitary coupled-cluster method

A Variational Coupled-Cluster Theory?

variational coupled-cluster theory

(

variational;tex2html_html_special_mark_quot;coupled-cluster theory

)

Wick's theorem

(, ), The Normal-Ordered Hamiltonian

generalized

Wick's Theorem

Wick's;tex2html_html_special_mark_quot;theorem

Algebraic Construction of the

generalized

Algebraic Construction of the

XCC

seeexpectation-value coupled-cluster;tex2html_html_special_mark_quot;method