Package org.jmol.quantum
Class QS
java.lang.Object
org.jmol.quantum.QS
Constants and static methods for quantum shells.
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Field Summary
FieldsModifier and TypeFieldDescriptionstatic final String
static final String
static final String
static final String
static final int
static final int
static final int
static final int
static final int
static final int
static final int
static final int
static final int
static final int[]
static final int
static int
private static final int
static final int
static final int
static final int
static final String[]
static final String[]
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Constructor Summary
Constructors -
Method Summary
Modifier and TypeMethodDescriptionstatic boolean
createDFMap
(int[] map, String fileList, String jmolList, int minLength) static int
getItem
(int i) static final String
getMOString
(float[] lc) static int[][]
private static int
getQuantumShell
(String tag) static final String
getQuantumShellTag
(int id) static int
static final int
static boolean
isQuantumBasisSupported
(char ch)
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Field Details
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S
public static final int S- See Also:
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P
public static final int P- See Also:
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SP
public static final int SP- See Also:
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DS
public static final int DS- See Also:
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DC
public static final int DC- See Also:
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FS
public static final int FS- See Also:
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FC
public static final int FC- See Also:
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GS
public static final int GS- See Also:
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GC
public static final int GC- See Also:
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HS
public static final int HS- See Also:
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HC
public static final int HC- See Also:
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IS
public static final int IS- See Also:
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IC
public static final int IC- See Also:
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MAX_TYPE_SUPPORTED
public static int MAX_TYPE_SUPPORTED -
MAXID
private static final int MAXID- See Also:
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idSpherical
public static final int[] idSpherical -
tags
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tags2
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CANONICAL_DC_LIST
- See Also:
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CANONICAL_DS_LIST
- See Also:
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CANONICAL_FC_LIST
- See Also:
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CANONICAL_FS_LIST
- See Also:
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Constructor Details
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QS
public QS()
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Method Details
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isQuantumBasisSupported
public static boolean isQuantumBasisSupported(char ch) -
getNewDfCoefMap
public static int[][] getNewDfCoefMap() -
getItem
public static int getItem(int i) -
getQuantumShellTagID
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getQuantumShell
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getQuantumShellTagIDSpherical
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getQuantumShellTag
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getMOString
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createDFMap
- Parameters:
map
- map to fillfileList
- reader-dependent listjmolList
- Jmol's reordering of that listminLength
- minimum token length so that "G 0" is not taken as two token -- depends upon reader- Returns:
- true if successful
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