make sure that output variables are initialized

This commit is contained in:
Axel Kohlmeyer
2023-02-26 00:16:03 -05:00
parent 3e2b5dd9d3
commit 76c879c388

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@ -72,6 +72,8 @@ FixPIMDNVT::FixPIMDNVT(LAMMPS *lmp, int narg, char **arg) : Fix(lmp, narg, arg)
nhc_eta_dotdot = nullptr;
nhc_eta_mass = nullptr;
spring_energy = t_sys = virial = 0.0;
method = PIMD;
fmass = 1.0;
nhc_temp = 298.15;