Daniel Lambrecht

University of Pittsburgh

Projects

Development of accurate force fields for aqueous biological environments using a massively parallel multiscale approach

Lead Institution

Intel Corporation

Principal Investigator

Jeffrey Hammond

Project type

Capability Research

The ability to calculate accurate energies and properties of large molecules with massively-parallel computers presents an extraordinary opportunity to develop new models for bonded and non-bonded…

Unveiling the structure, dynamics and spectral properties of aqueous clusters: A new theoretical approach

Lead Institution

University of California, Berkeley

Principal Investigator

Martin Head-Gordon

Project type

Exploratory Research

Elucidating the nature of aqueous solvation and in particular of hydrogen bonding are important for understanding chemical reactions in the atmosphere and at aqueous interfaces. Infrared (IR) and …