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S
Sergei Izvekov
Utah System of Higher Education
38
H指数
81
论文数
7.1K
被引数
0
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42
发表时间
发表时间
IF
被引数
Hierarchical Machine Learning of Low-Resolution Coarse-Grained Free Energy Potentials
JOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF
5.5
2023-05-31
4
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Microscopic mechanism of nanoscale shear bands in an energetic molecular crystal (α-RDX): A first-order structural phase transition
PHYSICAL REVIEW B
IF
3.7
2022-09-22
5
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Bottom-up coarse-grain modeling of nanoscale shear bands in shocked α-RDX
JOURNAL OF MATERIALS SCIENCE
IF
3.9
2022-03-23
10
PRE
AI
Izvekov, Sergei; Larentzos, James P.; Brennan, John K.; Rice, Betsy M.
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Bottom-up coarse-grain modeling of plasticity and nanoscale shear bands in α-RDX
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2021-08-11
16
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Microscopic derivation of coarse-grained, energy-conserving generalized Langevin dynamics
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2019-09-13
5
PRE
AI
Izvekov, Sergei
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Effect of a core-softened O-O interatomic interaction on the shock compression of fused silica
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2018-03-05
3
PRE
AI
Izvekov, Sergei; Weingarten, N. Scott; Byrd, Edward F. C.
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Multiscale Coarse-Graining with Effective Polarizabilities: A Fully Bottom-Up Approach
JOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF
5.5
2018-02-27
12
PRE
AI
Lafond, Patrick G.; Izvekov, Sergei
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Microscopic derivation of particle-based coarse-grained dynamics: Exact expression for memory function
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2017-03-24
26
PRE
AI
Izvekov, Sergei
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Multiscale Coarse-Graining of Polarizable Models through Force Matched Dipole Fluctuations
JOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF
5.5
2016-10-31
16
PRE
AI
Lafond, Patrick G.; Izvekov, Sergei
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A coarse-grain force field for RDX: Density dependent and energy conserving
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2016-03-14
69
OA
AI
Moore, Joshua D.; Barnes, Brian C.; Izvekov, Sergei; Lisal, Martin; Sellers, Michael S.; Taylor, DeCarlos E.; Brennan, John K.
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A new parameter-free soft-core potential for silica and its application to simulation of silica anomalies
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2015-12-29
11
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Multi-scale coarse-graining of non-conservative interactions in molecular liquids
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2014-03-10
41
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Microscopic derivation of particle-based coarse-grained dynamics
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2013-04-02
52
PRE
AI
Izvekov, Sergei
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Free-energy based pair-additive potentials for bulk Ni-Al systems: Application to study Ni-Al reactive alloying
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2012-09-05
11
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Mechanism of densification in silica glass under pressure as revealed by a bottom-up pairwise effective interaction model
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2012-04-06
19
PRE
AI
Izvekov, Sergei; Rice, Betsy M.
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Non-equilibrium molecular dynamics simulation study of heat transport in hexahydro-1,3,5-trinitro-s-triazine (RDX)
INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER
IF
5.8
2011-12-01
42
PRE
AI
Izvekov, Sergei; Chung, Peter W.; Rice, Betsy M.
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Particle-based multiscale coarse graining with density-dependent potentials: Application to molecular crystals (hexahydro-1,3,5-trinitro-s-triazine)
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2011-07-27
60
PRE
AI
Izvekov, Sergei; Chung, Peter W.; Rice, Betsy M.
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Using force-matching to reveal essential differences between density functionals in ab initio molecular dynamics simulations
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2011-05-18
16
OA
AI
Izvekov, Sergei; Swanson, Jessica M. J.
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Towards an understanding of many-particle effects in hydrophobic association in methane solutions
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2011-01-19
46
PRE
AI
Izvekov, Sergei
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Defining Condensed Phase Reactive Force Fields from ab Initio Molecular Dynamics Simulations: The Case of the Hydrated Excess Proton
JOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF
5.5
2010-09-23
44
PRE
AI
Knight, Chris; Maupin, C. Mark; Izvekov, Sergei; Voth, Gregory A.
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研究方向
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