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Amb aquesta obra es pretenen unificar els fonaments, els mètodes i les tècniques de la química teòrica i computacional. A més, val a dir que aquesta edició no tan sols va adreçada a estudiants de doctorat (amb l'objectiu de proporcionar-los un nivell adient per als seus estudis), sinó que la matèria que s'hi tracta està suficientment detallada perquè lectors no tan experts puguen accedir-hi sense dificultat