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N

Neil Shenvi

Duke University

24H指数
65论文数
3.2K被引数
收录论文 21
发表时间
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Tensor hypercontracted ppRPA: Reducing the cost of the particle-particle random phase approximation from O(r6) to O(r4)
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2014-07-14
err26
errOAAI
errShenvi, Neil; van Aggelen, Helen; Yang, Yang; Yang, Weitao
err分享
err收藏
The tensor hypercontracted parametric reduced density matrix algorithm: Coupled-cluster accuracy with O(r4) scaling
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2013-08-05
err25
errOAAI
errShenvi, Neil; van Aggelen, Helen; Yang, Yang; Yang, Weitao; Schwerdtfeger, Christine; Mazziotti, David
err分享
err收藏
Comparison of low-rank tensor expansions for the acceleration of quantum chemistry computations
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2013-07-17
err7
PREAI
errHoy, Erik P.; Shenvi, Neil; Mazziotti, David A.
err分享
err收藏
Achieving partial decoherence in surface hopping through phase correction
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2012-08-20
err44
PREAI
errShenvi, Neil; Yang, Weitao
err分享
err收藏
Multiquantum Vibrational Excitation of NO Scattered from Au(111): Quantitative Comparison of Benchmark Data to Ab Initio Theories of Nonadiabatic Molecule-Surface Interactions
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2012-04-04
err43
PREAI
errCooper, Russell; Bartels, Christof; Kandratsenka, Alexander; Rahinov, Igor; Shenvi, Neil; Golibrzuch, Kai; Li, Zhisheng; Auerbach, Daniel J.; Tully, John C.; Wodtke, Alec M.
err分享
err收藏
Nonadiabatic dynamics at metal surfaces: Independent electron surface hopping with phonon and electron thermostats
errFARADAY DISCUSSIONS
IF3.1
err2012-01-01
err25
PREAI
errShenvi, Neil; Tully, John C.
err分享
err收藏
An algebraic operator approach to electronic structure
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2011-12-30
err0
errOAAI
errShenvi, Neil; Yang, Weitao
err分享
err收藏
Phase-corrected surface hopping: Correcting the phase evolution of the electronic wavefunction
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2011-07-08
err102
PREAI
errShenvi, Neil; Subotnik, Joseph E.; Yang, Weitao
err分享
err收藏
Decoherence and surface hopping: When can averaging over initial conditions help capture the effects of wave packet separation?
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2011-06-29
err78
PREAI
errSubotnik, Joseph E.; Shenvi, Neil
err分享
err收藏
Simultaneous-trajectory surface hopping: A parameter-free algorithm for implementing decoherence in nonadiabatic dynamics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2011-04-08
err117
PREAI
errShenvi, Neil; Subotnik, Joseph E.; Yang, Weitao
err分享
err收藏
A new approach to decoherence and momentum rescaling in the surface hopping algorithm
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2011-01-11
err255
PREAI
errSubotnik, Joseph E.; Shenvi, Neil
err分享
err收藏
Dynamics of Open-Shell Species at Metal Surfaces
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2009-06-22
err21
PREAI
errRoy, Sharani; Shenvi, Neil; Tully, John C.
err分享
err收藏
The initial and final states of electron and energy transfer processes: Diabatization as motivated by system-solvent interactions
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-06-15
err143
PREAI
errSubotnik, Joseph E.; Cave, Robert J.; Steele, Ryan P.; Shenvi, Neil
err分享
err收藏
Nonadiabatic dynamics at metal surfaces: Independent-electron surface hopping
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-05-07
err183
PREAI
errShenvi, Neil; Roy, Sharani; Tully, John C.
err分享
err收藏
Model Hamiltonian for the interaction of NO with the Au(111) surface
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-05-07
err67
PREAI
errRoy, Sharani; Shenvi, Neil A.; Tully, John C.
err分享
err收藏
Controlling spin contamination using constrained density functional theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-09-19
err40
PREAI
errSchmidt, J. R.; Shenvi, Neil; Tully, John C.
err分享
err收藏
Vibrational relaxation of NO on Au(111) via electron-hole pair generation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2006-10-16
err52
PREAI
errShenvi, Neil; Roy, Sharani; Parandekar, Priya; Tully, John
err分享
err收藏
Qubit coherence control in a nuclear spin bath - art. no. 045310
errPHYSICAL REVIEW B
IF3.7
err2005-07-15
err26
errOAAI
errde Sousa, R; Shenvi, N; Whaley, KB
err分享
err收藏
Universal scaling of hyperfine-induced electron spin echo decay
errPHYSICAL REVIEW B
IF3.7
err2005-06-21
err60
errOAAI
errShenvi, N; de Sousa, R; Whaley, KB
err分享
err收藏
Nonperturbative bounds on electron spin coherence times induced by hyperfine interactions
errPHYSICAL REVIEW B
IF3.7
err2005-04-26
err20
errOAAI
errShenvi, N; de Sousa, R; Whaley, KB
err分享
err收藏

研究方向

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合作期刊
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Weitao Yang
H 指数: 96 · 论文数: 563
H
Herschel Rabitz
H 指数: 87 · 论文数: 1.3K
J
John C. Tully
H 指数: 82 · 论文数: 272
K
K. Birgitta Whaley
H 指数: 67 · 论文数: 418
D
Daniel J. Auerbach
H 指数: 67 · 论文数: 238
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