votca 2024.1-dev
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gauss_laguerre_quadrature.h
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1/*
2 * Copyright 2009-2020 The VOTCA Development Team
3 * (http://www.votca.org)
4 *
5 * Licensed under the Apache License, Version 2.0 (the "License")
6 *
7 * You may not use this file except in compliance with the License.
8 * You may obtain a copy of the License at
9 *
10 * http://www.apache.org/licenses/LICENSE-2.0
11 *
12 * Unless required by applicable law or agreed to in writing, software
13 * distributed under the License is distributed on an "AS IS" BASIS,
14 * WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
15 * See the License for the specific language governing permissions and
16 * limitations under the License.
17 *
18 */
19
20#ifndef VOTCA_XTP_GAUSS_LAGUERRE_QUADRATURE_H
21#define VOTCA_XTP_GAUSS_LAGUERRE_QUADRATURE_H
22
24
25namespace votca {
26namespace xtp {
27
29
30 public:
31 double ScaledPoint(Index i) const final { return points_[i]; }
32
33 double ScaledWeight(Index i) const final { return weights_[i]; }
34
35 protected:
36 // The laguerre method is suitable for integration limits a = 0 b =
37 // +infty. Here we have value1 and value2 because we split the original
38 // integral from -infty to +infty in two parts
39 bool UseSymmetry() const final { return true; }
40 void FillPoints() final;
41 void FillAdaptedWeights() final;
42};
43} // namespace xtp
44} // namespace votca
45
46#endif // VOTCA_XTP_GAUSS_LAGUERRE_QUADRATURE_H
base class for all analysis tools
Definition basebead.h:33
Eigen::Index Index
Definition types.h:26