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. 2022 Jul 25;5:84. doi: 10.1038/s42004-022-00701-8

Fig. 6. Results of the numerical simulation of ASP with |ΨBS〉 as the starting wave function and square function as the scheduling function in N2 molecule at R(N–N) = 3.0 Å.

Fig. 6

a The energy deviations from the CASCI values. b The square overlaps with the CASCI wave functions. c The 〈S2〉 values.