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E

Erik Deumens

State University System of Florida

26H指数
161论文数
2.5K被引数
收录论文 15
发表时间
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Application of Quantum Computing to Biochemical Systems: A Look to the Future
errFRONTIERS IN CHEMISTRY
IF4.2
err2020-11-24
err31
errOAAI
errCheng, Hai-Ping; Deumens, Erik; Freericks, James K.; Li, Chenglong; Sanders, Beverly A.
err分享
err收藏
Comment on a minimal implementation of the AMBER-GAUSSIAN interface for Ab Initio QM/MM-MD simulation关于从头开始QM/mm-md仿真的AMBER-GAUSSIAN接口的最小实现的评论
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2012-05-08
err3
errOAAI
errRoberts, Benjamin P.; Seabra, Gustavo M.; Roitberg, Adrian E.; Merz, Kenneth M.; Deumens, Erik; Torras, Juan; Trickey, Samuel B.
err分享
err收藏
Software design of ACES III with the super instruction architecture
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2011-06-28
err67
PREAI
errDeumens, Erik; Lotrich, Victor F.; Perera, Ajith; Ponton, Mark J.; Sanders, Beverly A.; Bartlett, Rodney J.
err分享
err收藏
Construction of basis sets for time-dependent studies
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-08-11
err3
PREAI
errGuevara, N. L.; Hall, B.; Teixeira, E.; Sabin, J. R.; Deumens, E.; Ohrn, Y.
err分享
err收藏
A versatile AMBER-Gaussian QM/MM interface through PUPIL
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2008-05-27
err38
PREAI
errTorras, Juan; Seabra, Gustavo De M.; Deumens, Erik; Trickey, S. B.; Roitberg, Adrian E.
err分享
err收藏
Parallel implementation of electronic structure energy, gradient, and Hessian calculations
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-05-20
err162
PREAI
errLotrich, V.; Flocke, N.; Ponton, M.; Yau, A. D.; Perera, A.; Deumens, E.; Bartlett, R. J.
err分享
err收藏
PUPIL: A systematic approach to software integration in multi-scale simulations
errCOMPUTER PHYSICS COMMUNICATIONS
IF3.4
err2007-08-01
err21
PREAI
errTorras, Juan; He, Yao; Cao, Chao; Muralidharan, Krishna; Deumens, E.; Cheng, H.-P.; Trickey, S. B.
err分享
err收藏
Fracture, water dissociation, and proton conduction in SiO2 nanochains
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2007-06-04
err22
PREAI
errCao, Chao; He, Yao; Torras, Juan; Deumens, Erik; Trickey, S. B.; Cheng, Hai-Ping
err分享
err收藏
Integral algorithm and density matrix integration scheme for ab initio band structure calculations on polymeric systems
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2002-09-27
err14
PREAI
errJacquemin, D; Champagne, B; André, JM; Deumens, E; Öhrn, Y
err分享
err收藏
Dynamics of proton-acetylene collisions at 30 eV
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2002-07-15
err21
PREAI
errMalinovskaya, SA; Cabrera-Trujillo, R; Sabin, JR; Deumens, E; Ohrn, Y
err分享
err收藏
Abstraction and exchange mechanisms for the D2+NH3+ reaction at hyperthermal collision energies
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2002-02-15
err20
PREAI
errCoutinho-Neto, M; Deumens, E; Öhrn, Y
err分享
err收藏
Trajectory and molecular binding effects in stopping cross section for hydrogen beams on H2
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2002-02-15
err29
PREAI
errCabrera-Trujillo, R; Öhrn, Y; Deumens, E; Sabin, JR
err分享
err收藏
Rovibrational analysis of molecular collisions using coherent states
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2001-11-08
err13
PREAI
errBlass, A; Deumens, E; Öhrn, Y
err分享
err收藏
Electron nuclear dynamics of proton collisions with methane at 30 eV
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err1997-10-22
err50
PREAI
errJacquemin, D; Morales, JA; Deumens, E; Ohrn, Y
err分享
err收藏
Vibrations and soliton dynamics of positively charged polyacetylene chains
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err1997-10-08
err48
errOAAI
errChampagne, B; Deumens, E; Ohrn, Y
err分享
err收藏

研究方向

暂时未获取到该数据
合作学者
合作期刊
R
Rodney J. Bartlett
H 指数: 119 · 论文数: 783
D
Denis Jacquemin
H 指数: 88 · 论文数: 1.0K
K
Kenneth M. Merz
H 指数: 83 · 论文数: 691
B
Benoı̂t Champagne
H 指数: 66 · 论文数: 813
Hai-Ping Cheng 封面图
Hai-Ping Cheng (Hai‐Ping Cheng)
H 指数: 65 · 论文数: 446
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