Skip to main content
. 2024 May 24;20(11):4591–4604. doi: 10.1021/acs.jctc.4c00139

Figure 2.

Figure 2

Torsion energy of ethylene from FN-DMC with JSD, JAGPn or JAGP wave functions. The values of JAGP and MR-CISD + Q (horizontal broken line) are taken from refs (59 and 76), respectively. The inset shows the structure of the planar and twisted ethylene.