psi::ObaraSaikaTwoCenterVIDerivRecursion Class Reference
[libmints: Integral library]
Obara and Saika recursion object for computing potential derivatives.
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#include <osrecur.h>
Inheritance diagram for psi::ObaraSaikaTwoCenterVIDerivRecursion:
Public Member Functions | |
| ObaraSaikaTwoCenterVIDerivRecursion (int max_am1, int max_am2) | |
| double *** | vx () const |
| double *** | vy () const |
| double *** | vz () const |
| virtual void | compute (double PA[3], double PB[3], double PC[3], double zeta, int am1, int am2) |
| Computes the potential integral 3D matrix using the data provided. | |
Protected Attributes | |
| double *** | vx_ |
| double *** | vy_ |
| double *** | vz_ |
Detailed Description
Obara and Saika recursion object for computing potential derivatives.The documentation for this class was generated from the following files:
- libmints/osrecur.h
- libmints/osrecur.cc
