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sc::G96XFunctional Class ReferenceImplements the Gill 1996 (G96) exchange functional.
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#include <functional.h>
Inheritance diagram for sc::G96XFunctional:
[legend]Collaboration diagram for sc::G96XFunctional:
[legend]List of all members.
Public Methods |
| G96XFunctional () |
| G96XFunctional (const Ref< KeyVal > &) |
| G96XFunctional (StateIn &) |
| ~G96XFunctional () |
void | save_data_state (StateOut &) |
| Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. More...
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int | need_density_gradient () |
void | point (const PointInputData &, PointOutputData &) |
Protected Methods |
void | init_constants () |
Protected Attributes |
double | b_ |
Detailed Description
Implements the Gill 1996 (G96) exchange functional.
P. M. W. Gill, Mol. Phys., 89(2), pp. 433-445, 1996.
Member Function Documentation
void sc::G96XFunctional::save_data_state |
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StateOut & |
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Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them.
This must be implemented by the derived class if the class has data.
Reimplemented from sc::DenFunctional. |
The documentation for this class was generated from the following file:
Generated at Fri Jan 10 08:14:53 2003 for MPQC
2.1.3 using the documentation package Doxygen
1.2.14.
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