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About us

Our research group focuses on the development of state-of-the-art quantum chemical models, particularly many-body methods such as perturbation theory and coupled cluster theory for accurate simulations of chiroptical properties. We are among the principal developers of PSI4, ab-initio quantum chemistry software.

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Contact us

Dr. T. Daniel Crawford
Department of Chemistry
Virginia Tech
Blacksburg, Virginia 24061
Phone: 540-231-7760
Fax: 540-231-3255
email: crawdad@vt.edu