Esempio n. 1
0
 def from_dict(cls, d):
     qadapter = None
     if d["qadapter"] is not None:
         qadapter = CommonAdapter.from_dict(d["qadapter"])
     return MPINTLammpsInput(MPINTLammps.from_dict(d["mplmp"]),
                             qadapter,
                             vis_logger=logging.getLogger(d["logger"]))
Esempio n. 2
0
 def from_dict(cls, d):
     qadapter = None
     if d["qadapter"] is not None:
         qadapter = CommonAdapter.from_dict(d["qadapter"])
     return MPINTLammpsInput(
         MPINTLammps.from_dict(d["mplmp"]),
         qadapter, 
         vis_logger = logging.getLogger(d["logger"]))
Esempio n. 3
0
 def from_dict(cls, d):
     incar = Incar.from_dict(d["incar"])
     poscar = Poscar.from_dict(d["poscar"])
     potcar = Potcar.from_dict(d["potcar"])
     kpoints = Kpoints.from_dict(d["kpoints"])
     qadapter = None
     if d["qadapter"] is not None:
         qadapter = CommonAdapter.from_dict(d["qadapter"])
     return MPINTVaspInputSet(d["name"], incar, poscar, potcar,
                              kpoints, qadapter, **d["kwargs"])
Esempio n. 4
0
 def from_dict(cls, d):
     incar = Incar.from_dict(d["incar"])
     poscar = Poscar.from_dict(d["poscar"])
     potcar = Potcar.from_dict(d["potcar"])
     kpoints = Kpoints.from_dict(d["kpoints"])
     qadapter = None
     if d["qadapter"] is not None:
         qadapter = CommonAdapter.from_dict(d["qadapter"])
     script_name = d["script_name"]
     return MPINTVaspInputSet(d["name"], incar, poscar, potcar,
                              kpoints, qadapter,
                              script_name=script_name,
                              vis_logger=logging.getLogger(d["logger"]),
                              **d["kwargs"])