Neil A. Shenvi, Ph.D.

Affiliations: 
2005 University of California, Berkeley, Berkeley, CA, United States 
Area:
Quantum Information and Computation, Quantum mechanics of clusters and nanomaterials, Chemical Physics
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K. Birgitta Whaley grad student 2005 UC Berkeley
 (Topics in quantum computation.)
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Publications

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Shenvi N, van Aggelen H, Yang Y, et al. (2014) Tensor hypercontracted ppRPA: reducing the cost of the particle-particle random phase approximation from O(r(6)) to O(r(4)). The Journal of Chemical Physics. 141: 024119
Shenvi N, van Aggelen H, Yang Y, et al. (2013) The tensor hypercontracted parametric reduced density matrix algorithm: coupled-cluster accuracy with O(r(4)) scaling. The Journal of Chemical Physics. 139: 054110
Hoy EP, Shenvi N, Mazziotti DA. (2013) Comparison of low-rank tensor expansions for the acceleration of quantum chemistry computations. The Journal of Chemical Physics. 139: 034105
Shenvi N, Yang W. (2012) Achieving partial decoherence in surface hopping through phase correction. The Journal of Chemical Physics. 137: 22A528
Shenvi N, Tully JC. (2012) Nonadiabatic dynamics at metal surfaces: independent electron surface hopping with phonon and electron thermostats. Faraday Discussions. 157: 325-35; discussion 3
Shenvi N, Yang W. (2011) An algebraic operator approach to electronic structure. The Journal of Chemical Physics. 135: 244111
Shenvi N, Subotnik JE, Yang W. (2011) Phase-corrected surface hopping: correcting the phase evolution of the electronic wavefunction. The Journal of Chemical Physics. 135: 024101
Subotnik JE, Shenvi N. (2011) Decoherence and surface hopping: when can averaging over initial conditions help capture the effects of wave packet separation? The Journal of Chemical Physics. 134: 244114
Shenvi N, Subotnik JE, Yang W. (2011) Simultaneous-trajectory surface hopping: a parameter-free algorithm for implementing decoherence in nonadiabatic dynamics. The Journal of Chemical Physics. 134: 144102
Subotnik JE, Shenvi N. (2011) A new approach to decoherence and momentum rescaling in the surface hopping algorithm. The Journal of Chemical Physics. 134: 024105
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