ABACUS/src/EXECS/Heis_DSF.cc

142 lines
6.0 KiB
C++

/**********************************************************
This software is part of J.-S. Caux's ABACUS library.
Copyright (c) J.-S. Caux
-----------------------------------------------------------
File: Heis_DSF.cc
Purpose: main function for ABACUS for Heisenberg spin-1/2 chain
***********************************************************/
#include "ABACUS.h"
using namespace std;
using namespace ABACUS;
int main(int argc, char* argv[])
{
if (argc != 8) { // provide some info
cout << endl << "Welcome to ABACUS\t(copyright J.-S. Caux)." << endl;
cout << endl << "Usage of Heis_DSF executable: " << endl;
cout << endl << "Provide the following arguments:" << endl << endl;
cout << "char whichDSF \t\t Which structure factor should be calculated ? Options are: m for S- S+, z for Sz Sz, p for S+ S-." << endl;
cout << "DP Delta \t\t Value of the anisotropy: use positive real values only" << endl;
cout << "int N \t\t\t Length (number of sites) of the system: use positive even integer values only" << endl;
cout << "int M \t\t\t Number of down spins: use positive integer values between 1 and N/2" << endl;
//cout << "int iKmin" << endl << "int iKmax \t\t Min and max momentum integers to scan over: recommended values: 0 and N" << endl;
cout << "int Max_Secs \t\t Allowed computational time: (in seconds)" << endl;
cout << "DP target_sumrule \t sumrule saturation you're satisfied with" << endl;
cout << "bool refine \t\t Is this a refinement of a earlier calculations ? (0 == false, 1 == true)" << endl;
cout << endl << "EXAMPLE: " << endl << endl;
cout << "Heis_DSF z 1.0 100 40 0 100 600 1.0 0" << endl << endl;
}
else if (argc == 8) { // !fixed_iK
int ctr = 1;
char whichDSF = *argv[ctr++];
DP Delta = atof(argv[ctr++]);
int N = atoi(argv[ctr++]);
int M = atoi(argv[ctr++]);
//int iKmin = atoi(argv[5]);
//int iKmax = atoi(argv[6]);
int Max_Secs = atoi(argv[ctr++]);
DP target_sumrule = atof(argv[ctr++]);
bool refine = (atoi(argv[ctr++]) == 1);
// We systematically scan over all momentum integers (to avoid problems with Brillouin folding
int iKmin = -1000*N;
int iKmax = 1000*N;
//Scan_Heis (whichDSF, Delta, N, M, iKmin, iKmax, Max_Secs, target_sumrule, refine, 0, 1);
Scan_Heis (whichDSF, Delta, N, M, iKmin, iKmax, Max_Secs, target_sumrule, refine);
}
// The argument given is the name of the standard args_Heis_DSF arguments file
/*
if (argc == 2) { // Used an input file to provide the arguments
if (strcmp(argv[1],"help") == 0) { // Output some instructions
cout << "Usage of Heis_DSF executable: " << endl;
cout << endl << "Provide arguments by either using one of the three following options:" << endl << endl;
cout << "1) via an argument file (see the template `args_Heis_DSF' in directory src/EXECS/), for example" << endl << endl;
cout << "Heis_DSF args_Heis_DSF" << endl << endl;
cout << "2) with arguments (for general momenta scan) whichDSF Delta N M iKmin iKmax Max_Secs refine, for example" << endl << endl;
cout << "Heis_DSF z 0.9 100 40 0 50 600 0" << endl << endl;
cout << "3) with arguments (for general momenta scan) whichDSF Delta N M iKneeded Max_Secs refine, for example" << endl << endl;
cout << "Heis_DSF z 0.9 100 40 20 600 0" << endl << endl;
}
else { // read argument file
ifstream argsfile;
argsfile.open(argv[1]);
if (argsfile.fail()) {
cout << argv[1] << endl;
ABACUSerror("Could not open arguments file.");
}
char junk[256];
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
char whichDSF; argsfile >> whichDSF;
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
DP Delta; argsfile >> Delta;
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
int N; argsfile >> N;
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
int M; argsfile >> M;
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
//bool fixed_iK; argsfile >> fixed_iK;
//while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
//int iKneeded; argsfile >> iKneeded;
int iKmin, iKmax; argsfile >> iKmin >> iKmax;
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
int Max_Secs; argsfile >> Max_Secs;
while (argsfile.peek() == '#' || argsfile.peek() == '\t' || argsfile.peek() == ' ' || argsfile.peek() == '\n') argsfile.getline(junk, 256);
bool refine; argsfile >> refine;
Scan_Heis (whichDSF, Delta, N, M, iKmin, iKmax, Max_Secs, refine);
}
} // if (argc == 2)
else if (argc == 8) { // fixed_iK
char whichDSF = *argv[1];
DP Delta = atof(argv[2]);
int N = atoi(argv[3]);
int M = atoi(argv[4]);
int iKneeded = atoi(argv[5]);
int Max_Secs = atoi(argv[6]);
bool refine = (atoi(argv[7]) == 1);
//Scan_Heis (whichDSF, Delta, N, M, iKneeded, Max_Secs, refine);
Scan_Heis (whichDSF, Delta, N, M, iKneeded, iKneeded, Max_Secs, refine);
}
else if (argc == 9) { // !fixed_iK
char whichDSF = *argv[1];
DP Delta = atof(argv[2]);
int N = atoi(argv[3]);
int M = atoi(argv[4]);
int iKmin = atoi(argv[5]);
int iKmax = atoi(argv[6]);
int Max_Secs = atoi(argv[7]);
bool refine = (atoi(argv[8]) == 1);
//Scan_Heis (whichDSF, Delta, N, M, iKneeded, Max_Secs, refine);
Scan_Heis (whichDSF, Delta, N, M, iKmin, iKmax, Max_Secs, refine);
}
else ABACUSerror("Wrong number of arguments to Heis_DSF executable.");
*/
return(0);
}