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Commit cbfba229 authored by Tobias WEBER's avatar Tobias WEBER
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Tobias Weber <tweber@ill.fr>
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GNU GENERAL PUBLIC LICENSE
Version 2, June 1991
Copyright (C) 1989, 1991 Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA
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Makefile deleted 100644 → 0
View file @ 4bb4a9de
#
# MnSi dynamics module for Takin and helper tools
# @author Tobias Weber <tweber@ill.fr>
# @date 2018-2020
# @license GPLv2 (see 'LICENSE' file)
#
mingw_build = 0
debug_build = 0
strip_bins = 1
# -----------------------------------------------------------------------------
# setup
# -----------------------------------------------------------------------------
ifneq ($(mingw_build), 1)
ifeq ("$(CXX)", "")
CXX = g++
endif
SYSINCS = -I/usr/local/include \
-I/usr/include/lapacke -I/usr/local/opt/lapack/include \
-I/usr/include/qt5 -I/usr/include/x86_64-linux-gnu/qt5/ \
#-I/home/tw/build/boost_1_73_0
LIBDIRS = -L/usr/local/opt/lapack/lib -L/usr/local/lib
LIBBOOSTSYS = -lboost_system
LIBBOOSTFILESYS = -lboost_filesystem
BIN_SUFFIX =
else
CXX = x86_64-w64-mingw32-g++
SYSINCS = -I/usr/x86_64-w64-mingw32/sys-root/mingw/include \
-I/usr/x86_64-w64-mingw32/sys-root/mingw/include/qt5
LIBDIRS = -L/usr/x86_64-w64-mingw32/sys-root/mingw/bin/
LIBBOOSTSYS = -lboost_system-x64
LIBBOOSTFILESYS = -lboost_filesystem-x64
BIN_SUFFIX = .exe
endif
ifneq ($(debug_build), 1)
OPT = -O2 #-march=native
ifeq ($(strip_bins), 1)
STRIP = strip
else
STRIP = echo -e "Not stripping"
endif
else
OPT = -g -ggdb
STRIP = echo -e "Not stripping"
endif
STD = -std=c++17
LIBDEFS = -fPIC
DEFS = -DDEF_SKX_ORDER=7 -DDEF_HELI_ORDER=7 \
-DNO_MINIMISATION -DNO_REDEFINITIONS \
-D__HACK_FULL_INST__ #-DPLUGIN_APPLI
INCS = -Isrc -Iext -Iext/takin $(SYSINCS)
# -----------------------------------------------------------------------------
# -----------------------------------------------------------------------------
# meta rules
# -----------------------------------------------------------------------------
.PHONY: all clean
all: prepare lib/skxmod.so lib/skxmod_grid.so \
bin/genskx bin/merge bin/convert bin/dump \
bin/drawskx bin/dyn bin/weight \
# bin/heliphase bin/skx_gs bin/weight_sum
clean:
find . -name "*.o" -exec rm -fv {} \;
rm -rfv bin/
rm -rfv lib/
prepare:
mkdir -p bin/
mkdir -p lib/
# -----------------------------------------------------------------------------
# -----------------------------------------------------------------------------
# Takin plugin modules
# -----------------------------------------------------------------------------
lib/skxmod.so: src/takin/takin.o src/core/skx.o src/core/fp.o src/core/heli.o src/core/longfluct.o src/core/magsys.o \
ext/takin/tools/monteconvo/sqwbase.o ext/tlibs2/libs/log.o
@echo "Linking Takin module $@..."
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) $(LIBDEFS) -shared -o $@ $+ -llapacke
$(STRIP) $@
lib/skxmod_grid.so: src/takin/takin_grid.o ext/takin/tools/monteconvo/sqwbase.o ext/tlibs2/libs/log.o
@echo "Linking Takin grid module $@..."
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) $(LIBDEFS) -shared -o $@ $+ $(LIBBOOSTSYS) -lQt5Core
$(STRIP) $@
# -----------------------------------------------------------------------------
# -----------------------------------------------------------------------------
# tools
# -----------------------------------------------------------------------------
bin/genskx: src/takin/genskx.o src/core/skx.o src/core/magsys.o ext/tlibs2/libs/log.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) $(LIBDEFS) -o $@ $+ $(LIBBOOSTFILESYS) -llapacke -lpthread
$(STRIP) $@$(BIN_SUFFIX)
bin/merge: src/takin/merge.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) -o $@ $+ $(LIBBOOSTSYS)
$(STRIP) $@$(BIN_SUFFIX)
bin/convert: src/takin/convert.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) -o $@ $+
$(STRIP) $@$(BIN_SUFFIX)
bin/dump: src/takin/dump.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) -o $@ $+
$(STRIP) $@$(BIN_SUFFIX)
bin/drawskx: src/calc/drawskx.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) -o $@ $+
$(STRIP) $@$(BIN_SUFFIX)
bin/dyn: src/calc/dyn.o src/core/skx.o src/core/fp.o src/core/heli.o src/core/magsys.o ext/tlibs2/libs/log.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) $(LIBDEFS) -o $@ $+ -llapacke -lpthread
$(STRIP) $@$(BIN_SUFFIX)
bin/weight: src/calc/weight.o src/core/skx.o src/core/fp.o src/core/heli.o src/core/magsys.o ext/tlibs2/libs/log.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) $(LIBDEFS) -o $@ $+ -llapacke -lpthread
$(STRIP) $@$(BIN_SUFFIX)
bin/weight_sum: src/calc/weight_sum.o src/core/skx.o src/core/fp.o src/core/heli.o src/core/magsys.o ext/tlibs2/libs/log.o
$(CXX) $(STD) $(OPT) $(DEFS) $(LIBDIRS) $(LIBDEFS) -o $@ $+ -llapacke -lpthread
$(STRIP) $@$(BIN_SUFFIX)
# -----------------------------------------------------------------------------
# -----------------------------------------------------------------------------
# further tools needing specialised compilation options
# -----------------------------------------------------------------------------
bin/heliphase: src/calc/heliphase.cpp src/core/heli.cpp src/core/magsys.cpp ext/tlibs2/libs/log.cpp
$(CXX) $(STD) $(OPT) $(INCS) -DDEF_HELI_ORDER=4 -DNO_REDEFINITIONS -D__HACK_FULL_INST__ $(LIBDIRS) -o $@ $+ -lMinuit2 -llapacke -lgomp
$(STRIP) $@$(BIN_SUFFIX)
bin/skx_gs: src/calc/skx_gs.cpp src/core/skx.cpp src/core/heli.cpp src/core/magsys.cpp ext/tlibs2/libs/log.cpp
$(CXX) $(STD) $(OPT) $(INCS) -DDEF_SKX_ORDER=7 -DDEF_HELI_ORDER=7 -DNO_REDEFINITIONS -D__HACK_FULL_INST__ $(LIBDIRS) -o $@ $+ -lMinuit2 -llapacke -lgomp
$(STRIP) $@$(BIN_SUFFIX)
# -----------------------------------------------------------------------------
# -----------------------------------------------------------------------------
# general rules
# -----------------------------------------------------------------------------
%.o: %.cpp
@echo "Compiling $< -> $@..."
$(CXX) $(STD) $(OPT) $(DEFS) $(INCS) $(LIBDEFS) -c $< -o $@
# -----------------------------------------------------------------------------
NOTES deleted 100644 → 0
View file @ 4bb4a9de
Manual compilation of takin external plugins:
x86_64-w64-mingw32-g++ -std=c++17 -O2 -Isrc -Iext -Iext/takin -I/usr/x86_64-w64-mingw32/sys-root/mingw/include -I/usr/x86_64-w64-mingw32/sys-root/mingw/include/qt5 -L/usr/x86_64-w64-mingw32/sys-root/mingw/bin/ -DDEF_SKX_ORDER=7 -DDEF_HELI_ORDER=7 -DNO_MINIMISATION -DNO_REDEFINITIONS -D__HACK_FULL_INST__ -DPLUGIN_APPLI -o takinmod_skx.exe src/takin/takin.cpp src/core/skx.cpp src/core/heli.cpp src/core/fp.cpp src/core/magsys.cpp ext/takin/tools/monteconvo/sqwbase.cpp ext/tlibs2/libs/log.cpp ext/tlibs/log/log.cpp ext/tlibs/math/rand.cpp -llapacke -lboost_system-x64 -lboost_filesystem-x64
g++ -std=c++17 -O2 -Isrc -Iext -Iext/takin -I/usr/local/include -I/usr/include/lapacke -I/usr/local/opt/lapack/include -L/usr/x86_64-w64-mingw32/sys-root/mingw/bin/ -DDEF_SKX_ORDER=7 -DDEF_HELI_ORDER=7 -DNO_MINIMISATION -DNO_REDEFINITIONS -D__HACK_FULL_INST__ -DPLUGIN_APPLI -o takinmod_skx src/takin/takin.cpp src/core/skx.cpp src/core/heli.cpp src/core/fp.cpp src/core/magsys.cpp ext/takin/tools/monteconvo/sqwbase.cpp ext/tlibs2/libs/log.cpp ext/tlibs/log/log.cpp ext/tlibs/math/rand.cpp -llapacke -lboost_system -lboost_filesystem -lrt -lpthread
Manual compilation of Takin plugins:
x86_64-w64-mingw32-g++ -std=c++17 -O2 -shared -fPIC -Isrc -Iext -Iext/takin -I/usr/x86_64-w64-mingw32/sys-root/mingw/include -I/usr/x86_64-w64-mingw32/sys-root/mingw/include/qt5 -L/usr/x86_64-w64-mingw32/sys-root/mingw/bin/ -DDEF_SKX_ORDER=7 -DDEF_HELI_ORDER=7 -DNO_MINIMISATION -DNO_REDEFINITIONS -D__HACK_FULL_INST__ -o lib/skxmod.dll src/takin/takin.cpp src/core/skx.cpp src/core/heli.cpp src/core/fp.cpp src/core/magsys.cpp ext/takin/tools/monteconvo/sqwbase.cpp ext/tlibs2/libs/log.cpp ext/tlibs/log/log.cpp ext/tlibs/math/rand.cpp -llapacke -lboost_system-x64 -lboost_filesystem-x64
x86_64-w64-mingw32-g++ -std=c++17 -O2 -shared -fPIC -DNO_REDEFINITIONS -Isrc -Iext -Iext/takin -I/usr/x86_64-w64-mingw32/sys-root/mingw/include -I/usr/x86_64-w64-mingw32/sys-root/mingw/include/qt5 -I/usr/include/qt5 -I/usr/include/x86_64-linux-gnu/qt5/ -L/usr/x86_64-w64-mingw32/sys-root/mingw/bin/ -o lib/skxmod_grid.dll src/takin/takin_grid.cpp ext/takin/tools/monteconvo/sqwbase.cpp ext/tlibs2/libs/log.cpp ext/tlibs/log/log.cpp ext/tlibs/math/rand.cpp -lboost_system-x64 -lboost_filesystem-x64 -lQt5Core
Grid test:
g++ -std=c++17 -DDO_TEST -fPIC -o grid_tst -Isrc -Iext -Iext/takin -I/usr/include/qt5 -I/usr/include/x86_64-linux-gnu/qt5/ -DNO_REDEFINITIONS src/takin/takin_grid.cpp ext/takin/tools/monteconvo/sqwbase.cpp ext/tlibs2/libs/log.cpp -lboost_system -lQt5Core
README.md
View file @ cbfba229
This is the code for the Takin MnSi plugin module and its helper tools.
It calculates the dispersion and the dynamical structure factor for the
helimagnetic, the field-polarised, and the skyrmion phase of MnSi.
The ext/ directory contains the source code of the external libraries on
which this code depends.
The development repository can be found here:
https://code.ill.fr/tweber/takin-mnsi
This code has been used in the following papers:
- https://doi.org/10.1103/PhysRevB.100.060404
- https://doi.org/10.1103/PhysRevB.97.224403
- https://doi.org/10.1063/1.5041036
This repository has moved to
[https://code.ill.fr/scientific-software/takin/plugins/mnsi](https://code.ill.fr/scientific-software/takin/plugins/mnsi).
## This repository has moved to [https://code.ill.fr/scientific-software/takin/plugins/mnsi](https://code.ill.fr/scientific-software/takin/plugins/mnsi).
ext/setup_externals.sh deleted 100755 → 0
View file @ 4bb4a9de
#!/bin/bash
#
# downloads external dependencies
# @author Tobias Weber <tweber@ill.fr>
# @date 9-apr-20
# @license GPLv2
#
if [ -L takin ] || [ -d takin ]; then
echo -e "A takin directory already exists. Skipping.";
else
echo -e "Cloning takin/core..."
git clone https://code.ill.fr/scientific-software/takin/core.git
mv -v core takin
fi
if [ -L tlibs ] || [ -d tlibs ]; then
echo -e "A tlibs directory already exists. Skipping.";
else
echo -e "Cloning tlibs..."
git clone https://code.ill.fr/scientific-software/takin/tlibs.git
fi
if [ -L takin2 ] || [ -d takin2 ]; then
echo -e "A takin2 directory already exists. Skipping.";
else
echo -e "Cloning takin/mag-core repo..."
git clone https://code.ill.fr/scientific-software/takin/mag-core.git
mv -v mag-core takin2
fi
if [ -L tlibs2 ] || [ -d tlibs2 ]; then
echo -e "A tlibs2 directory already exists. Skipping.";
else
echo -e "Cloning tlibs2 repo..."
git clone https://code.ill.fr/scientific-software/takin/tlibs2.git
fi
if [ -L tlibs2-mag ] || [ -d tlibs2-mag ]; then
echo -e "A tlibs2-mag directory already exists. Skipping.";
else
echo -e "Cloning tlibs2-mag repo..."
git clone https://code.ill.fr/tweber/tlibs2_magnon_helpers.git
mv -v tlibs2_magnon_helpers tlibs2-mag
cp -v tlibs2-mag/mag.h tlibs2/libs/
fi
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Tobias Weber <tweber@ill.fr>
ext/tlibs2-mag/LICENSE deleted 100644 → 0
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ext/tlibs2-mag/mag.h deleted 100644 → 0
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/**
* tlibs2 -- magnon helper functions in preparation for the main tlibs2 repo: https://code.ill.fr/scientific-software/takin/tlibs2
* @author Tobias Weber <tweber@ill.fr>
* @date 30-may-2020
* @license GPLv2 or GPLv3, see 'LICENSE' file
* @desc based on the mathematical formalism of the skyrmion and helimagnon models by M. Garst and J. Waizner, 2016-2020, references:
* - https://doi.org/10.1088/1361-6463/aa7573
* - https://doi.org/10.1038/nmat4223 (supplement)
* - https://kups.ub.uni-koeln.de/7937/
* @desc forked on 7-Nov-2018 from my privately developed "tlibs" project (https://github.com/t-weber/tlibs).
*/
#ifndef __TLIBS2_PHYS_MAG__
#define __TLIBS2_PHYS_MAG__
#include "math17.h"
// default optimisation flags
#ifndef MX_IS_HERM
#define MX_IS_HERM 1
#endif
#ifndef MXX_IS_DIAG
#define MXX_IS_DIAG 1
#endif
#ifndef INTERACTMAT_IS_HERM
// warning: setting this to "1" leads to false low-q eigenvectors!
#define INTERACTMAT_IS_HERM 0
#endif
#if !defined(__TL2_STRCONV0) && !defined(__TL2_STRCONV)
#define __TL2_STRCONV0(__DEF) #__DEF
#define __TL2_STRCONV(__DEF) __TL2_STRCONV0(__DEF)
#endif
#pragma message("MX_IS_HERM: " __TL2_STRCONV(MX_IS_HERM))
#pragma message("MXX_IS_DIAG: " __TL2_STRCONV(MXX_IS_DIAG))
#pragma message("INTERACTMAT_IS_HERM: " __TL2_STRCONV(INTERACTMAT_IS_HERM))
namespace tl2 {
/**
* Calculates energies and dynamical structure factors from Landau-Lifshitz (M x) and fluctuation matrices.
*/
template<class t_mat_cplx, class t_vec_cplx, class t_cplx, class t_real>
std::tuple<std::vector<t_cplx>, std::vector<t_vec_cplx>, std::vector<t_mat_cplx>>
calc_dynstrucfact_landau(const t_mat_cplx& Mx, const t_mat_cplx& Fluc,
t_real normfac=1, const t_real* mineval = nullptr, const t_real *maxeval = nullptr,