Searched refs:dExc_db (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | xc_adiabatic_methods.F | 69 db_dEx2, dc_dDFA, dc_ddW0, dc_dEx1, dc_dEx2, dExc_da, dExc_db, dExc_dc, dfa_energy, & local
100 dExc_db = 1.0_dp/c - (LOG(ABS(1.0_dp + c))/(c*c))
118 scale_dEx1 = dExc_da*da_dEx1 + dExc_db*db_dEx1 + dExc_dc*dc_dEx1
119 scale_ddW0 = dExc_da*da_ddW0 + dExc_db*db_ddW0 + dExc_dc*dc_ddW0
120 scale_dDFA = dExc_da*da_dDFA + dExc_db*db_dDFA + dExc_dc*dc_dDFA
121 scale_dEx2 = dExc_da*da_dEx2 + dExc_db*db_dEx2 + dExc_dc*dc_dEx2
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | xc_adiabatic_methods.F | 69 db_dEx2, dc_dDFA, dc_ddW0, dc_dEx1, dc_dEx2, dExc_da, dExc_db, dExc_dc, dfa_energy, & local
100 dExc_db = 1.0_dp/c - (LOG(ABS(1.0_dp + c))/(c*c))
118 scale_dEx1 = dExc_da*da_dEx1 + dExc_db*db_dEx1 + dExc_dc*dc_dEx1
119 scale_ddW0 = dExc_da*da_ddW0 + dExc_db*db_ddW0 + dExc_dc*dc_ddW0
120 scale_dDFA = dExc_da*da_dDFA + dExc_db*db_dDFA + dExc_dc*dc_dDFA
121 scale_dEx2 = dExc_da*da_dEx2 + dExc_db*db_dEx2 + dExc_dc*dc_dEx2
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