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Use unique_ptr instead of raw pointer

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This commit is contained in:
Dominik Demuth
2026-03-08 11:28:02 +01:00
parent d44e762bf7
commit ef3cd31be6
27 changed files with 248 additions and 259 deletions
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28
src/motions/sixsitejump.cpp
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@@ -1,21 +1,17 @@
#include "sixsitejump.h"
#include <iomanip>
#include <iostream>
#include "coordinates.h"
namespace motions {
SixSiteOctahedronC3::SixSiteOctahedronC3(const double delta, const double eta, const double chi, std::mt19937_64& rng) :
m_chi{chi*M_PI/180.},
BaseMotion(std::string{"SixSiteOctahedral"}, delta, eta, rng) {}
SixSiteOctahedronC3::SixSiteOctahedronC3(const double delta, const double eta, const double chi) :
BaseMotion(std::string{"SixSiteOctahedral"}, delta, eta),
m_chi{chi*M_PI/180.} {}
SixSiteOctahedronC3::SixSiteOctahedronC3(std::mt19937_64& rng) : BaseMotion(std::string{"SixSiteOctahedralC3"}, rng) {}
SixSiteOctahedronC3::SixSiteOctahedronC3() : BaseMotion(std::string{"SixSiteOctahedralC3"}) {}
void SixSiteOctahedronC3::initialize() {
const coordinates::SphericalPos c3_axis = draw_position();
const auto [x, y, z] = spherical_to_xyz(c3_axis);
const double alpha = 2. * M_PI * m_uni_dist(m_rng);
void SixSiteOctahedronC3::initialize(std::mt19937_64& rng) {
const coordinates::SphericalPos c3_axis = draw_position(rng);
const double alpha = 2. * M_PI * m_uni_dist(rng);
const double m_chi_opposite = M_PI - m_chi;
@@ -24,17 +20,21 @@ namespace motions {
m_corners[2*i+1] = omega_q(rotate(c3_axis, m_chi_opposite, alpha + i * 2./3.*M_PI + M_PI/3.));
}
m_initial_omega = SixSiteOctahedronC3::jump();
m_initial_omega = SixSiteOctahedronC3::jump(rng);
}
double SixSiteOctahedronC3::jump() {
m_corner_idx += m_chooser(m_rng);
double SixSiteOctahedronC3::jump(std::mt19937_64& rng) {
m_corner_idx += m_chooser(rng);
m_corner_idx %= 6;
return m_corners[m_corner_idx];
}
std::unique_ptr<BaseMotion> SixSiteOctahedronC3::clone() const {
return std::make_unique<SixSiteOctahedronC3>(*this);
}
std::string SixSiteOctahedronC3::toString() const {
return {"SixSiteOctahedral/angle=" + std::to_string(m_chi / M_PI * 180.)};
}