Loading src/SPIN/compute_spin.cpp +0 −1 Changes for src/SPIN/compute_spin.cpp: 0 added lines, 1 removed line. Original line number Diff line number Diff line Loading @@ -132,7 +132,6 @@ void ComputeSpin::compute_vector() magtot[2] *= scale; magtot[3] = sqrt((magtot[0]*magtot[0])+(magtot[1]*magtot[1])+(magtot[2]*magtot[2])); spintemperature = hbar*tempnumtot; //spintemperature /= (2.0*kb*tempdenomtot); spintemperature /= (kb*tempdenomtot); vector[0] = magtot[0]; Loading src/SPIN/fix_langevin_spin.cpp +0 −7 Changes for src/SPIN/fix_langevin_spin.cpp: 0 added lines, 7 removed lines. Original line number Diff line number Diff line Loading @@ -134,10 +134,8 @@ void FixLangevinSpin::init() double hbar = force->hplanck/MY_2PI; // eV/(rad.THz) double kb = force->boltz; // eV/K D = (MY_2PI*alpha_t*gil_factor*kb*temp); //D = (alpha_t*gil_factor*kb*temp); D /= (hbar*dts); sigma = sqrt(2.0*D); //sigma = sqrt(D); } /* ---------------------------------------------------------------------- */ Loading Loading @@ -176,11 +174,6 @@ void FixLangevinSpin::add_temperature(double fmi[3]) double rx = sigma*(2.0*random->uniform() - 1.0); double ry = sigma*(2.0*random->uniform() - 1.0); double rz = sigma*(2.0*random->uniform() - 1.0); //printf("test rd : %g \n",2.0*random->uniform() - 1.0); //printf("test gaussian : %g \n", random->gaussian()); //double rx = sigma*(random->gaussian()); //double ry = sigma*(random->gaussian()); //double rz = sigma*(random->gaussian()); // adding the random field Loading Loading
src/SPIN/compute_spin.cpp +0 −1 Changes for src/SPIN/compute_spin.cpp: 0 added lines, 1 removed line. Original line number Diff line number Diff line Loading @@ -132,7 +132,6 @@ void ComputeSpin::compute_vector() magtot[2] *= scale; magtot[3] = sqrt((magtot[0]*magtot[0])+(magtot[1]*magtot[1])+(magtot[2]*magtot[2])); spintemperature = hbar*tempnumtot; //spintemperature /= (2.0*kb*tempdenomtot); spintemperature /= (kb*tempdenomtot); vector[0] = magtot[0]; Loading
src/SPIN/fix_langevin_spin.cpp +0 −7 Changes for src/SPIN/fix_langevin_spin.cpp: 0 added lines, 7 removed lines. Original line number Diff line number Diff line Loading @@ -134,10 +134,8 @@ void FixLangevinSpin::init() double hbar = force->hplanck/MY_2PI; // eV/(rad.THz) double kb = force->boltz; // eV/K D = (MY_2PI*alpha_t*gil_factor*kb*temp); //D = (alpha_t*gil_factor*kb*temp); D /= (hbar*dts); sigma = sqrt(2.0*D); //sigma = sqrt(D); } /* ---------------------------------------------------------------------- */ Loading Loading @@ -176,11 +174,6 @@ void FixLangevinSpin::add_temperature(double fmi[3]) double rx = sigma*(2.0*random->uniform() - 1.0); double ry = sigma*(2.0*random->uniform() - 1.0); double rz = sigma*(2.0*random->uniform() - 1.0); //printf("test rd : %g \n",2.0*random->uniform() - 1.0); //printf("test gaussian : %g \n", random->gaussian()); //double rx = sigma*(random->gaussian()); //double ry = sigma*(random->gaussian()); //double rz = sigma*(random->gaussian()); // adding the random field Loading
