00532nam a2200181 a 450000500170000002000180001708200130003510000320004824500910008026000370017130000270020850000190023560000080025463000570026263000190031985600060033885600060034420251222125949.0  a9783319410920  a541bTEI  aTeixeira-Dias, Jose J.C.d_  aMolecular physical chemistryba computer-based approach using Mathematica and Gaussian  aCham,SwitzerlandbSpringerc2017  axiv,457 p.c24 cm.bHB  aIncludes index  bc_  aChemistry, Physical and theoretical--Data processing  aThermodynamics  f_  a_