- Generated on for ergo by
1.14.0
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ergo
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#include <functionals.h>
Public Attributes | |
| real | rhoa |
| real | rhob |
| real | grada |
| real | gradb |
| real | gradab |
| real FunDensProp_::grada |
Referenced by becke_energy(), becke_first(), becke_fourth(), becke_second(), becke_third(), callbackGga(), cam_energy(), cam_first(), cam_fourth(), cam_second(), cam_third(), dftene_(), dftpot0_(), dftptf0_(), kt_energy(), kt_first(), kt_fourth(), kt_second(), kt_third(), lb94_first(), lb94_second(), lin_resp_cb_b_gga(), lyp_energy(), lyp_first(), lyp_fourth(), lyp_second(), lyp_third(), optx_energy(), optx_first(), optx_second(), optx_third(), p86c_energy(), p86c_first(), p86c_second(), p86c_third(), pbec_energy(), pbec_first(), pbec_second(), pbex_energy(), pbex_first(), pbex_second(), pbex_third(), pw86x_energy(), pw86x_first(), pw91c_energy(), pw91c_first(), pw91c_second(), pw91c_third(), pw91x_energy(), pw91x_first(), pw91x_fourth(), pw91x_second(), pw91x_third(), pw92c_energy(), pw92c_first(), pw92c_second(), pw92c_third(), test_first(), test_fourth(), test_second(), test_third(), xcCallbackGgaR(), and xcCallbackGgaU().
| real FunDensProp_::gradab |
Referenced by callbackGga(), cam_energy(), cam_first(), cam_fourth(), cam_second(), cam_third(), dftene_(), dftptf0_(), lb94_second(), lin_resp_cb_b_gga(), lyp_energy(), lyp_first(), lyp_fourth(), lyp_second(), lyp_third(), p86c_energy(), p86c_first(), p86c_second(), p86c_third(), pbec_energy(), pbec_first(), pbec_second(), pw91c_energy(), pw91c_first(), pw91c_second(), pw91c_third(), pw92c_energy(), pw92c_first(), pw92c_second(), pw92c_third(), test_first(), test_fourth(), test_second(), test_third(), xcCallbackGgaR(), and xcCallbackGgaU().
| real FunDensProp_::gradb |
Referenced by becke_energy(), becke_first(), becke_fourth(), becke_second(), becke_third(), callbackGga(), cam_energy(), cam_first(), cam_fourth(), cam_second(), cam_third(), dftene_(), dftpot0_(), dftptf0_(), kt_energy(), kt_first(), kt_fourth(), kt_second(), kt_third(), lb94_first(), lb94_second(), lin_resp_cb_b_gga(), lyp_energy(), lyp_first(), lyp_fourth(), lyp_second(), lyp_third(), optx_energy(), optx_first(), optx_second(), optx_third(), p86c_energy(), p86c_first(), p86c_second(), p86c_third(), pbec_energy(), pbec_first(), pbec_second(), pbex_energy(), pbex_first(), pbex_second(), pbex_third(), pw86x_energy(), pw86x_first(), pw91c_energy(), pw91c_first(), pw91c_second(), pw91c_third(), pw91x_energy(), pw91x_first(), pw91x_fourth(), pw91x_second(), pw91x_third(), pw92c_energy(), pw92c_first(), pw92c_second(), pw92c_third(), test_first(), test_fourth(), test_second(), test_third(), xcCallbackGgaR(), and xcCallbackGgaU().
| real FunDensProp_::rhoa |
Referenced by becke_energy(), becke_first(), becke_fourth(), becke_second(), becke_third(), callbackGga(), callbackLda(), cam_energy(), cam_first(), cam_fourth(), cam_second(), cam_third(), dftene_(), dftpot1_(), dftptf0_(), kt_energy(), kt_first(), kt_fourth(), kt_second(), kt_third(), lb94_first(), lb94_second(), lin_resp_cb_b_lda(), lyp_energy(), lyp_first(), lyp_fourth(), lyp_second(), lyp_third(), optx_energy(), optx_first(), optx_second(), optx_third(), p86c_energy(), p86c_first(), p86c_second(), p86c_third(), par_energy(), par_first(), par_second(), par_third(), pbec_energy(), pbec_first(), pbec_second(), pbex_energy(), pbex_first(), pbex_second(), pbex_third(), pw86x_energy(), pw86x_first(), pw91c_energy(), pw91c_first(), pw91c_second(), pw91c_third(), pw91x_energy(), pw91x_first(), pw91x_fourth(), pw91x_second(), pw91x_third(), pw92c_energy(), pw92c_first(), pw92c_second(), pw92c_third(), pz81_energy(), pz81_first(), pz81_second(), pz81_third(), pz81a_energy(), pz81a_first(), pz81a_second(), pz81a_third(), pz81b_energy(), pz81b_first(), pz81b_second(), pz81b_third(), slater_energy(), slater_first(), slater_fourth(), slater_second(), slater_third(), spni_energy(), spni_first(), spni_second(), test_first(), vwn_fourth(), xcCallbackGgaR(), xcCallbackGgaU(), xcCallbackLdaR(), and xcCallbackLdaU().
| real FunDensProp_::rhob |
Referenced by becke_energy(), becke_first(), becke_fourth(), becke_second(), becke_third(), callbackGga(), cam_energy(), cam_first(), cam_fourth(), cam_second(), cam_third(), dftene_(), dftpot1_(), dftptf0_(), kt_energy(), kt_first(), kt_fourth(), kt_second(), kt_third(), lb94_first(), lb94_second(), lin_resp_cb_b_lda(), lyp_energy(), lyp_first(), lyp_fourth(), lyp_second(), lyp_third(), optx_energy(), optx_first(), optx_second(), optx_third(), p86c_energy(), p86c_first(), p86c_second(), p86c_third(), par_energy(), par_first(), par_second(), par_third(), pbec_energy(), pbec_first(), pbec_second(), pbex_energy(), pbex_first(), pbex_second(), pbex_third(), pw86x_energy(), pw86x_first(), pw91c_energy(), pw91c_first(), pw91c_second(), pw91c_third(), pw91x_energy(), pw91x_first(), pw91x_fourth(), pw91x_second(), pw91x_third(), pw92c_energy(), pw92c_first(), pw92c_second(), pw92c_third(), pz81_energy(), pz81_first(), pz81_second(), pz81_third(), pz81a_energy(), pz81a_first(), pz81a_second(), pz81a_third(), pz81b_energy(), pz81b_first(), pz81b_second(), pz81b_third(), slater_energy(), slater_first(), slater_fourth(), slater_second(), slater_third(), spni_energy(), spni_first(), spni_second(), vwn_fourth(), xcCallbackGgaR(), xcCallbackGgaU(), and xcCallbackLdaU().
1.14.0