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java.lang.Objectorg.jmol.adapter.smarter.AtomSetCollectionReader
org.jmol.adapter.readers.quantum.BasisFunctionReader
org.jmol.adapter.readers.quantum.SpartanReader
public class SpartanReader
Field Summary |
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Fields inherited from class org.jmol.adapter.readers.quantum.BasisFunctionReader |
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alphaBeta, CANONICAL_DC_LIST, CANONICAL_DS_LIST, CANONICAL_FC_LIST, CANONICAL_FS_LIST, dfCoefMaps, ignoreMOs, moData, nOrbitals, orbitals, shells |
Constructor Summary | |
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SpartanReader()
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Method Summary | |
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void |
initializeReader()
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private boolean |
isSpartanArchive(java.lang.String strNotArchive)
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private void |
readAtoms()
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private void |
readFrequencies()
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Methods inherited from class org.jmol.adapter.readers.quantum.BasisFunctionReader |
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canonicalizeQuantumSubshellTag, filterMO, fixSlaterTypes, getDfCoefMaps, getDFMap, isQuantumBasisSupported, setMO |
Methods inherited from class java.lang.Object |
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clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait |
Constructor Detail |
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public SpartanReader()
Method Detail |
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public void initializeReader() throws java.lang.Exception
initializeReader
in class AtomSetCollectionReader
java.lang.Exception
private boolean isSpartanArchive(java.lang.String strNotArchive) throws java.lang.Exception
java.lang.Exception
private void readAtoms() throws java.lang.Exception
java.lang.Exception
private void readFrequencies() throws java.lang.Exception
java.lang.Exception
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