Fixed Numerus functions in the SetGlobals file and MolHandling, translated DicePlayer and tested till, such as inertia_tensor, add_type, center_of_mass_to_origin. standard_orientation; and removed chglevel keyword
Signed-off-by: Vitor Hideyoshi <vitor.h.n.batista@gmail.com>
Fixed Numerus functions in the SetGlobals file and MolHandling, translated DicePlayer and tested till printing of initial geometry for cyc==1
Signed-off-by: Vitor Hideyoshi <vitor.h.n.batista@gmail.com>
Initial work in the tradution of SetGlobals and Logistics in the use of classes for the management of processes and threaded works
Signed-off-by: Vitor Hideyoshi <vitor.h.n.batista@gmail.com>
In this commit most of the work about Molecules and the Quantum Mechanical System has been finished, the only part still missing if a method that populates de ASSEC, but this method requires the Classes: Dice, Player and Gaussian
Signed-off-by: Vitor Hideyoshi <vitor.h.n.batista@gmail.com>
In this commit were created a System class to manage the functions between two atoms and various new functions were translated
Signed-off-by: Vitor Hideyoshi <vitor.h.n.batista@gmail.com>
