Class QS


  • public class QS
    extends java.lang.Object
    Constants and static methods for quantum shells.
    • Constructor Detail

      • QS

        public QS()
    • Method Detail

      • isQuantumBasisSupported

        public static boolean isQuantumBasisSupported​(char ch)
      • getNewDfCoefMap

        public static int[][] getNewDfCoefMap()
      • getItem

        public static int getItem​(int i)
      • getQuantumShellTagID

        public static int getQuantumShellTagID​(java.lang.String tag)
      • getQuantumShell

        private static int getQuantumShell​(java.lang.String tag)
      • getQuantumShellTagIDSpherical

        public static final int getQuantumShellTagIDSpherical​(java.lang.String tag)
      • getQuantumShellTag

        public static final java.lang.String getQuantumShellTag​(int id)
      • getMOString

        public static final java.lang.String getMOString​(float[] lc)
      • createDFMap

        public static boolean createDFMap​(int[] map,
                                          java.lang.String fileList,
                                          java.lang.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