• Contents
  • Index
  • Search
  • General Information
    • EXPO2014 installation
    • Tutorials
    • Preparing input file
  • Indexing by N-TREOR09
  • Space group determination
  • Structure solution by Direct Methods
    • All steps of structure solution procedure
      • Extraction of the integrated intensities
      • Normalization of the integrated intensities
      • Estimate of structure invariants
      • Application of the tangent formula
      • Crystal structure completion and refinement
  • Structure solution by Direct Space methods
  • Direct Methods combined with Simulated Annealing
  • Rietveld Refinement
  • Commands of EXPO2014 and their use
    • Description of EXPO2014 commands
    • Preparation of data
  • Examples
  • Crystal Structure Visualization
    • How to
    • File
    • Modify
    • Select
    • View
    • Tools
    • Info
  • ab-initio structure
  • Description of commands
    • DATA module
    • DIRECT module
    • EXTRACTION module
    • FOURIER/LEAST-SQUARES module
    • INVARIANTS module
    • Labelling procedure
    • NORMAL module
    • N-TREOR module
    • PATTERSON module
    • PHASE module
    • POLPO procedures
    • RIETVELD module
  • indexing
    • background
    • FWHM
    • M20
    • N-TREOR09
    • peak-search
  • Praparation of data
  • program
  • SA+DM
    • construction of the models
    • Direct Methods
    • Directives in simulated annealing command
    • external trial structure
    • table of connectivity
  • Simulated Annealing
    • B(iso)
    • Cost function
    • Directives in simulated annealing command
    • Number of moves
    • structural model
  • Space group Determination
    • extinction symbols
    • extracted intensities
    • full pattern decomposition
    • indexation step
    • input file
    • Wilson method
  • Strategies
    • failure
    • RBM
    • RES
  • Structure Solution
    • Direct Methods
    • Directives in extraction
    • Directives in fourier command
    • Directives in invariants command
    • Directives in normal command
    • Directives in phase command
    • E-map
    • extraction
    • figure of merit
    • fourier
    • invariants
    • normal
    • phase
    • quartets
    • RBM
    • structure factor amplitudes
    • The convergence procedure
    • the tangent routine