diff options
Diffstat (limited to 'src/GeneralizedPolynomial-Uniform/common/3d.cube.size2')
5 files changed, 40 insertions, 0 deletions
diff --git a/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/coeffs-dcl.h b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/coeffs-dcl.h new file mode 100644 index 0000000..fc144be --- /dev/null +++ b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/coeffs-dcl.h @@ -0,0 +1,8 @@ +fp coeff_0_0_0; +fp coeff_p1_0_0; +fp coeff_0_p1_0; +fp coeff_p1_p1_0; +fp coeff_0_0_p1; +fp coeff_p1_0_p1; +fp coeff_0_p1_p1; +fp coeff_p1_p1_p1; diff --git a/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/data-dcl.h b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/data-dcl.h new file mode 100644 index 0000000..a45f786 --- /dev/null +++ b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/data-dcl.h @@ -0,0 +1,8 @@ +fp data_0_0_0; +fp data_p1_0_0; +fp data_0_p1_0; +fp data_p1_p1_0; +fp data_0_0_p1; +fp data_p1_0_p1; +fp data_0_p1_p1; +fp data_p1_p1_p1; diff --git a/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/evaluate-molecule.c b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/evaluate-molecule.c new file mode 100644 index 0000000..ca7209f --- /dev/null +++ b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/evaluate-molecule.c @@ -0,0 +1,8 @@ + coeffs->coeff_0_0_0*data->data_0_0_0 + + coeffs->coeff_p1_0_0*data->data_p1_0_0 + + coeffs->coeff_0_p1_0*data->data_0_p1_0 + + coeffs->coeff_p1_p1_0*data->data_p1_p1_0 + + coeffs->coeff_0_0_p1*data->data_0_0_p1 + + coeffs->coeff_p1_0_p1*data->data_p1_0_p1 + + coeffs->coeff_0_p1_p1*data->data_0_p1_p1 + + coeffs->coeff_p1_p1_p1*data->data_p1_p1_p1; diff --git a/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/fetch-data.c b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/fetch-data.c new file mode 100644 index 0000000..7390485 --- /dev/null +++ b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/fetch-data.c @@ -0,0 +1,8 @@ +data->data_0_0_0 = DATA(0,0,0); +data->data_p1_0_0 = DATA(1,0,0); +data->data_0_p1_0 = DATA(0,1,0); +data->data_p1_p1_0 = DATA(1,1,0); +data->data_0_0_p1 = DATA(0,0,1); +data->data_p1_0_p1 = DATA(1,0,1); +data->data_0_p1_p1 = DATA(0,1,1); +data->data_p1_p1_p1 = DATA(1,1,1); diff --git a/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/store-coeffs.c b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/store-coeffs.c new file mode 100644 index 0000000..aa3d643 --- /dev/null +++ b/src/GeneralizedPolynomial-Uniform/common/3d.cube.size2/store-coeffs.c @@ -0,0 +1,8 @@ +COEFF(0,0,0) = factor * coeffs->coeff_0_0_0; +COEFF(1,0,0) = factor * coeffs->coeff_p1_0_0; +COEFF(0,1,0) = factor * coeffs->coeff_0_p1_0; +COEFF(1,1,0) = factor * coeffs->coeff_p1_p1_0; +COEFF(0,0,1) = factor * coeffs->coeff_0_0_p1; +COEFF(1,0,1) = factor * coeffs->coeff_p1_0_p1; +COEFF(0,1,1) = factor * coeffs->coeff_0_p1_p1; +COEFF(1,1,1) = factor * coeffs->coeff_p1_p1_p1; |