message: changing to only DevX file
diff: @@ -14,7 +14,6 @@ limitations under the License.
  */
  #include <iostream>
  #include "soap.h"
  -#include "soapGTO.h"
  #include "soapGeneral.h"
  #include "soapGTODevX.h"
  #include "geometry.h"
  @@ -104,6 +103,32 @@ void SOAPGTO::create(
  this->average,
  cell_list
  );
  + soapGTODevX(
  + derivatives,
  + out,
  + xd,
  + yd,
  + zd,
  + cd,
  + positions,
  + centers,
  + center_indices,
  + this->alphas,
  + this->betas,
  + atomic_numbers,
  + this->species,
  + this->rcut,
  + this->cutoff_padding,
  + n_atoms,
  + this->nmax,
  + this->lmax,
  + n_centers,
  + this->eta,
  + this->crossover,
  + indices,
  + true,
  + false
  + );
  }
  void SOAPGTO::create_cartesian(
  