LSMP2LT

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Revision as of 10:11, 19 July 2022 by Huebsch (talk | contribs)

LSMP2LT = .FALSE. | .TRUE. 

Default: LSMP2LT = .FALSE.

Description: LSMP2LT selects a stochastic Laplace transformed MP2 algorithm.

If LSMP2LT=.TRUE. and ALGO=ACFTDRK is set, a quartic scaling stochastic Laplace transformed MP2 algorithm is selected.[1]

This tag should be used in combination with KPAR to tweak parallelization as described in this tutorial.

Related tags and articles

NOMEGA, ESTOP, NSTORB, KPAR, ALGO

Examples that use this tag

  1. ↑ T. Schäfer, B. Ramberger, and G. Kresse, J. Chem. Phys. 146, 104101 (2017).
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