psi4.core.Functional¶
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class
psi4.core.Functional¶ Bases:
objectdocstring
Methods Summary
alpha((self: psi4.core.Functional) -> float)docstring build_base((alias: str) -> psi4.core.Functional)docstring citation((self: psi4.core.Functional) -> str)docstring description((self: psi4.core.Functional) -> str)docstring is_gga((self: psi4.core.Functional) -> bool)docstring is_lrc((self: psi4.core.Functional) -> bool)docstring is_meta((self: psi4.core.Functional) -> bool)docstring lsda_cutoff(...)docstring meta_cutoff(...)docstring name((self: psi4.core.Functional) -> str)docstring omega((self: psi4.core.Functional) -> float)docstring print_detail(...)docstring print_out((self: psi4.core.Functional) -> None)docstring set_alpha((self: psi4.core.Functional, ...)docstring set_citation((self: psi4.core.Functional, ...)docstring set_description((self: psi4.core.Functional, ...)docstring set_gga((self: psi4.core.Functional, ...)docstring set_lsda_cutoff((self: psi4.core.Functional, ...)docstring set_meta((self: psi4.core.Functional, ...)docstring set_meta_cutoff((self: psi4.core.Functional, ...)docstring set_name((self: psi4.core.Functional, ...)docstring set_omega((self: psi4.core.Functional, ...)docstring set_parameter((self: psi4.core.Functional, ...)docstring Methods Documentation
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alpha(self: psi4.core.Functional) → float¶ docstring
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build_base(alias: str) → psi4.core.Functional¶ docstring
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citation(self: psi4.core.Functional) → str¶ docstring
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description(self: psi4.core.Functional) → str¶ docstring
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is_gga(self: psi4.core.Functional) → bool¶ docstring
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is_lrc(self: psi4.core.Functional) → bool¶ docstring
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is_meta(self: psi4.core.Functional) → bool¶ docstring
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lsda_cutoff(self: psi4.core.Functional) → float¶ docstring
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meta_cutoff(self: psi4.core.Functional) → float¶ docstring
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name(self: psi4.core.Functional) → str¶ docstring
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omega(self: psi4.core.Functional) → float¶ docstring
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print_detail(self: psi4.core.SuperFunctional, arg0: int) → None¶ docstring
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print_out(self: psi4.core.Functional) → None¶ docstring
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set_alpha(self: psi4.core.Functional, arg0: float) → None¶ docstring
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set_citation(self: psi4.core.Functional, arg0: str) → None¶ docstring
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set_description(self: psi4.core.Functional, arg0: str) → None¶ docstring
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set_gga(self: psi4.core.Functional, arg0: bool) → None¶ docstring
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set_lsda_cutoff(self: psi4.core.Functional, arg0: float) → None¶ docstring
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set_meta(self: psi4.core.Functional, arg0: bool) → None¶ docstring
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set_meta_cutoff(self: psi4.core.Functional, arg0: float) → None¶ docstring
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set_name(self: psi4.core.Functional, arg0: str) → None¶ docstring
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set_omega(self: psi4.core.Functional, arg0: float) → None¶ docstring
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set_parameter(self: psi4.core.Functional, arg0: str, arg1: float) → None¶ docstring
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alpha(self: psi4.core.Functional) → float docstring
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build_base(alias: str) → psi4.core.Functional docstring
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citation(self: psi4.core.Functional) → str docstring
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description(self: psi4.core.Functional) → str docstring
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is_gga(self: psi4.core.Functional) → bool docstring
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is_lrc(self: psi4.core.Functional) → bool docstring
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is_meta(self: psi4.core.Functional) → bool docstring
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lsda_cutoff(self: psi4.core.Functional) → float docstring
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meta_cutoff(self: psi4.core.Functional) → float docstring
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name(self: psi4.core.Functional) → str docstring
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omega(self: psi4.core.Functional) → float docstring
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print_detail(self: psi4.core.SuperFunctional, arg0: int) → None docstring
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print_out(self: psi4.core.Functional) → None docstring
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set_alpha(self: psi4.core.Functional, arg0: float) → None docstring
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set_citation(self: psi4.core.Functional, arg0: str) → None docstring
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set_description(self: psi4.core.Functional, arg0: str) → None docstring
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set_gga(self: psi4.core.Functional, arg0: bool) → None docstring
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set_lsda_cutoff(self: psi4.core.Functional, arg0: float) → None docstring
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set_meta(self: psi4.core.Functional, arg0: bool) → None docstring
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set_meta_cutoff(self: psi4.core.Functional, arg0: float) → None docstring
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set_name(self: psi4.core.Functional, arg0: str) → None docstring
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set_omega(self: psi4.core.Functional, arg0: float) → None docstring
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set_parameter(self: psi4.core.Functional, arg0: str, arg1: float) → None docstring
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