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documentation:language_reference:functions:createspectra [2018/07/25 16:14]
Simon Heinze minor typo
documentation:language_reference:functions:createspectra [2018/09/24 16:36] (current)
Simon Heinze Standard -> Default
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   * $\psi$ : Wavefunction or a list of Wavefunctions   * $\psi$ : Wavefunction or a list of Wavefunctions
   * Possible options are:   * Possible options are:
-    * "​NTri"​ Positive integer specifying the number of states in the Krylov basis. (Standard ​value 200) +    * "​NTri"​ Positive integer specifying the number of states in the Krylov basis. (Default ​value 200) 
-    * "​epsilon"​ Positive real defining the smallest absolute value considered different than zero. (Standard ​value 1.49E-8)+    * "​epsilon"​ Positive real defining the smallest absolute value considered different than zero. (Default ​value 1.49E-8)
     * "​restrictions"​ A list of restrictions defining restrictions on configurations and occupations included. Allows one to do restricted active space calculations     * "​restrictions"​ A list of restrictions defining restrictions on configurations and occupations included. Allows one to do restricted active space calculations
-    * "​Emin"​ Real value defining the minimum energy in the spectra (Standard ​value determined such that the spectrum fits into the range +    * "​Emin"​ Real value defining the minimum energy in the spectra (Default ​value determined such that the spectrum fits into the range 
-    * "​Emax"​ Real value defining the maximum energy in the spectra (Standard ​value determined such that the spectrum fits into the range +    * "​Emax"​ Real value defining the maximum energy in the spectra (Default ​value determined such that the spectrum fits into the range 
-    * "​NE"​ Positive integer defining the number of points in the spectrum. (Standard ​value 1000) +    * "​NE"​ Positive integer defining the number of points in the spectrum. (Default ​value 1000) 
-    * "​Gamma"​ Positive real defining the full width half maximum Lorenzian broadening. (Standard ​value 10*(Emax-Emin)/​NE)  +    * "​Gamma"​ Positive real defining the full width half maximum Lorenzian broadening. (Default ​value 10*(Emax-Emin)/​NE)  
-    * "​Tensor"​ Bolean defining if off diagonal elements are calculated or not. (Standard ​false)+    * "​Tensor"​ Bolean defining if off diagonal elements are calculated or not. (Default ​false)
  
 ===== Output ===== ===== Output =====
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