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Searched refs:total_energy_xc (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dxc_adiabatic_methods.F57 scale_dEx2, total_energy_xc) argument
64 scale_dEx2, total_energy_xc local
123 total_energy_xc = a + b/(c*c)*(c - LOG(ABS(1.0_dp + c)))
H A Dxc_adiabatic_utils.F85 scale_dEx2, total_energy_xc local
138 scale_dEx2, total_energy_xc)
177 energy%exc = total_energy_xc
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dxc_adiabatic_methods.F57 scale_dEx2, total_energy_xc) argument
64 scale_dEx2, total_energy_xc local
123 total_energy_xc = a + b/(c*c)*(c - LOG(ABS(1.0_dp + c)))
H A Dxc_adiabatic_utils.F85 scale_dEx2, total_energy_xc local
137 scale_dEx2, total_energy_xc)
174 energy%exc = total_energy_xc