diff --git a/src/ML-IAP/mliap_descriptor_ace.cpp b/src/ML-IAP/mliap_descriptor_ace.cpp index 12e6c64166..95a042d879 100644 --- a/src/ML-IAP/mliap_descriptor_ace.cpp +++ b/src/ML-IAP/mliap_descriptor_ace.cpp @@ -213,7 +213,7 @@ void MLIAPDescriptorACE::compute_forces(class MLIAPData *data) const double ztmp = x[i][2]; for (int jj = 0; jj < jnum; jj++) { - const int j = jlist[jj] & NEIGMASK; + const int j = jlist[jj] & NEIGHMASK; for (int idim = 0; idim < 3; idim++) { fij[idim] = 0.0; } for (int iicoeff = 0; iicoeff < ndescriptors; iicoeff++) { DOUBLE_TYPE fx_dB =