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minor dox cleanup
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doc/classdoc/doxygen.cfg.in

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@@ -423,7 +423,7 @@ WARN_LOGFILE =
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# directories like "/usr/src/myproject". Separate the files or directories
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# with spaces.
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INPUT = @top_srcdir@/src/bin \
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INPUT = @top_srcdir@/src/bin/libint \
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@top_srcdir@/src/lib/libint \
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@top_srcdir@/include \
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@top_srcdir@/doc
@@ -449,7 +449,7 @@ RECURSIVE = YES
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# excluded from the INPUT source files. This way you can easily exclude a
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# subdirectory from a directory tree whose root is specified with the INPUT tag.
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EXCLUDE =
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EXCLUDE = @top_srcdir@/src/bin/libint/build_libint.cc
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# The EXCLUDE_SYMLINKS tag can be used select whether or not files or directories
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# that are symbolic links (a Unix filesystem feature) are excluded from the input.

include/libint2/engine.h

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@@ -89,13 +89,14 @@ enum class Operator {
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overlap = 0, //!< overlap
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kinetic, //!< electronic kinetic energy, i.e. \f$ -\frac{1}{2} \nabla^2 \f$
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nuclear, //!< Coulomb potential due to point charges
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emultipole1, //!< overlap + (Cartesian) electric dipole moment, \f$ x_O, y_O,
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//! z_O \f$, where \f$ x_O \equiv x - O_x \f$ is relative to
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//! origin \f$ \vec{O} \f$
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emultipole2, //!< emultipole1 + (Cartesian) electric quadrupole moment, \f$
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//! x^2, xy, xz, y^2, yz, z^2 \f$
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emultipole3, //!< emultipole2 + (Cartesian) electric octupole moment, \f$
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//! x^3, x^2y, x^2z, xy^2, xyz, xz^2, y^3, y^2z, yz^2, z^3 \f$
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emultipole1, //!< overlap + (Cartesian) electric dipole moment,
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//! \f$ x_O, y_O, z_O \f$, where
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//! \f$ x_O \equiv x - O_x \f$ is relative to
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//! origin \f$ \vec{O} \f$
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emultipole2, //!< emultipole1 + (Cartesian) electric quadrupole moment,
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//! \f$ x^2, xy, xz, y^2, yz, z^2 \f$
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emultipole3, //!< emultipole2 + (Cartesian) electric octupole moment,
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//! \f$ x^3, x^2y, x^2z, xy^2, xyz, xz^2, y^3, y^2z, yz^2, z^3 \f$
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delta, //!< \f$ \delta(\vec{r}_1 - \vec{r}_2) \f$
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coulomb, //!< (2-body) Coulomb operator = \f$ r_{12}^{-1} \f$
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r12_m1 = coulomb, //!< alias for Operator::coulomb

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