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Appendix A. Keyword Reference |  |
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Appendix A. Keyword Reference | |
TRUSTG — Default method for gradient minimization using trust radii.
TRUSTG
Minimize gradient using the TRUST algorithm for transition state refinement. Note that TRUSTG is slower than TRUSTE. (Recommended and encouraged!)
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Copyright © 1992-2013 Semichem, Inc. All rights reserved. |
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TS |