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LIST OF KEYWORDS

PREFACE

  Release 2000.02

1 GENERAL

  1.1 INTRODUCTION
    Characterization of BAND

2 INPUT

  2.1 INTRODUCTION
    Format of the Input file
    Units
    Energy and Potential XC Functionals
    Examples
    Setting up an Input File
    Numerical Atoms, Basis functions, and Fit functions

  2.2 MAIN OPTIONS
    Energy Functional
    Precision
    Self-consistency
    Restarts
    Reference and Startup Atoms
    Printed Output
    Fragments
    More Analysis

3 RECOMMENDATIONS, PROBLEMS, QUESTIONS

  3.1 RECOMMENDATIONS

  3.2 TROUBLE SHOOTING
    Basis set dependency

4 APPENDICES

  4.1 LIST OF KEYS
    First List
    Second List
    Third List

  4.2 AUXILIARY INPUT FEATURES

REFERENCES


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