Class QS

java.lang.Object
org.jmol.quantum.QS
public class QS extends Object
Constants and static methods for quantum shells.

  • Field Details

  • Constructor Details

    • QS

      public QS()

  • Method Details

    • isQuantumBasisSupported

      public static boolean isQuantumBasisSupported(char ch)

    • getNewDfCoefMap

      public static int[][] getNewDfCoefMap()

    • getItem

      public static int getItem(int i)

    • getQuantumShellTagID

      public static int getQuantumShellTagID(String tag)

    • getQuantumShellTagIDSpherical

      public static final int getQuantumShellTagIDSpherical(String tag)

    • getQuantumShellTag

      public static final String getQuantumShellTag(int id)

    • getMOString

      public static final String getMOString(float[] lc)

    • createDFMap

      public static boolean createDFMap(int[] map, String fileList, String jmolList, int minLength)
      Parameters:
      map - map to fill
      fileList - reader-dependent list
      jmolList - Jmol's reordering of that list
      minLength - minimum token length so that "G 0" is not taken as two token -- depends upon reader
      Returns:
      true if successful