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remove the fprintf debug outputs

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oywg11
2023-06-06 08:27:14 +08:00
parent 3282470cf5
commit c558de3ce0
1 changed files with 0 additions and 14 deletions
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14
src/INTERLAYER/pair_ilp_tmd.cpp
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@ -336,9 +336,6 @@ void PairILPTMD::ILP_neigh()
}
} // end of idenfying the first neighbor
} else if (n > Nnei) {
fprintf(screen, "Molecule ID = %d\n", imol);
fprintf(screen, "Atom Type = %d\n", type[i]);
fprintf(screen, "Neinum = %d\n", n);
error->one(FLERR,
"There are too many neighbors for TMD atoms, please check your configuration");
}
@ -497,9 +494,6 @@ void PairILPTMD::calc_normal()
vect[0][1] = x[jH2][1] - ytp;
vect[0][2] = x[jH2][2] - ztp;
} else {
fprintf(screen, "jH1 jH2 = %d %d\n", jH1,jH2);
fprintf(screen, "Atom Type = %d %d\n", type[jH1],type[jH2]);
fprintf(screen, "For atom i = %d %d\n", tag[i],type[i]);
error->one(FLERR, "The order of atoms in water molecule should be O H H !");
}
}
@ -662,9 +656,6 @@ void PairILPTMD::calc_normal()
cont = 2;
} else {
fprintf(screen, "jH1 jH2 = %d %d\n", jH1,jH2);
fprintf(screen, "Atom Type = %d %d\n", type[jH1],type[jH2]);
fprintf(screen, "ID and type of atom i = %d %d\n", tag[i],type[i]);
error->one(FLERR, "The order of atoms in water molecule should be O H H !");
}
}
@ -728,11 +719,6 @@ void PairILPTMD::calc_normal()
dnormdri[i][id][ip] = dpvdri[id][ip] / nn - Nave[id] * dni[ip] / nn2;
}
}
// printf("%4d:\t%e %e %e\n\t%e %e %e\n\t%e %e %e\n",
// i, dnormdri[i][0][0], dnormdri[i][0][1], dnormdri[i][0][2],
// dnormdri[i][1][0],dnormdri[i][1][1],dnormdri[i][1][2],
// dnormdri[i][2][0],dnormdri[i][2][1],dnormdri[i][2][2]);
// exit(0);
}
else if (cont >= 3) {
error->one(FLERR,