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Searched refs:av_d2V_dAlpha2_ (Results 1 – 1 of 1) sorted by relevance

/dports/science/plumed/plumed2-2.7.2/src/ves/
H A DVesDeltaF.cpp159 std::vector<double> av_d2V_dAlpha2_; member in PLMD::ves::VesDeltaF
331 av_d2V_dAlpha2_.resize(sym_alpha_size_,0); in VesDeltaF()
561 av_d2V_dAlpha2_[ij]+=(d2V_dAlpha2[ij]-av_d2V_dAlpha2_[ij])/av_counter_; in update()
584 std::fill(av_d2V_dAlpha2_.begin(),av_d2V_dAlpha2_.end(),0); in update()
644 multi_sim_comm.Sum(av_d2V_dAlpha2_); in update_alpha()
650 av_d2V_dAlpha2_[ij]/=NumWalkers_; in update_alpha()
657 comm.Bcast(av_d2V_dAlpha2_,0); in update_alpha()
673 …(av_dV_dAlpha_prod_[ij]-av_dV_dAlpha_[i]*av_dV_dAlpha_[j])+tg_d2V_dAlpha2_[ij]-av_d2V_dAlpha2_[ij]; in update_alpha()