邓声威

本硕博：均毕业于华东理工大学 (博士论文：非均质聚合物材料力学性能的计算机模拟)

博士期间访学：约翰斯·霍普金斯大学(马里兰，美国) 材料系，研究内容：聚合物材料力学性能

博士后阶段：以色列理工学院(海法，以色列)机械工程系，研究方向：聚合物纤维合成制备及力学性能

2017年入职浙江工业大学化工学院，目前从事高分子材料方面的理论及应用研究。

本科生课程：物理化学

主持的国家级科研项目：

国家自然科学基金项目-企业创新发展联合基金(重点，浙工大负责人) “基于反应-扩散的PBT推进剂与衬层界面黏接强度形成机制及增强设计” 2023.1-2026.12

国家自然科学基金面上项目 “负载型纳米贵金属催化剂纳微孔道内分子扩散机制及其调控规律研究” 2022.1-2025.12

国家重点研发计划(子课题) “固废资源化”重点专项--废乘用车轮胎高效裂解与副产物综合利用技术” 2019.1-2022.12 已结题

国家自然科学基金青基 “质子交换膜燃料电池阴极催化剂层关键物系传递的多尺度模拟” 2018.1-2020.12 已结题

主持的企业委托研发项目：

1、药用辅料丙烯酸接枝淀粉的合成及工艺开发（江西阿尔法高科药业有限公司）2024-06-03 在研

2、一种低硼超轻粘土的生产工艺研究（浙江一正文化用品有限公司） 2022-08-09  已结题

3、一种光学透明胶带配方工艺的开发（宁波润禾高新材料科技股份有限公司）2021-02-17 已结题

4、一种高粘性耐高温溶剂型丙烯酸压敏胶的合成工艺开发（湖南省益思迪科技有限公司）2021-02-17 在研

5、一种耐磨高分子复合材料的生产工艺研究（浙江一正文化用品有限公司）2019-02-17 已结题

6、一种热塑性弹性体材料的生产工艺研究（浦江县一正文具制造有限公司）2017-07-16 已结题

授权专利及软著：

1、一种光固化防静电泡棉胶带的合成 工艺，专利号：ZL202110801493.9

2、一种基于静电纺丝技术的高拉伸模量聚合物纳米复合纤维的制备方法，专利号：ZL201811496271.5

3、一种耐高温光固化丙烯酸泡棉胶带的合成工艺，专利号：ZL202110801491. X

4、一种高弹性光固化丙烯酸泡棉胶带的合成工艺，专利号：ZL202110796348.6

5、PBT叠氮推进剂聚合物交联网络力学性能预测软件V1.0，登记号：2021SR1677598

6、复合材料粘接强度预测软件V1.0，登记号:2024SR0771884

7、橡胶硫化体系力学性能预测软件V1.0，登记号：2020SR0253313

8、粘弹性聚合物复合材料力学性能预测软件V1.0，登记号:2024SR0771904

9、负载型纳米金属催化剂界面分子力场生成软件V1.0，登记号:2024SR0773053

通讯作者论文

(1) Machine Learning-based High Throughput Screening for High-Stability Polyimides. Industrial & Engineering Chemistry Research. 2024. 63, 21110-21122.

(2) In-situ Water Separation Enhanced Methyl Glycolate Oxidation to Methyl Glyoxylate by Catalytic Membrane Reactor. Journal of Membrane Science, 2025. 123403.

(3) Effect of metal ion intercalation on the gas diffusion confined in two-dimensional MXene nanosheets. Materials Today Communications 2024, 38, 107897.

(4) Curing and Cross-Linking Processes in the Poly (3, 3-bis-azidomethyl oxetane)-tetrahydrofuran/Toluene Diisocyanate/Trimethylolpropane System: A Density Functional Theory and Accelerated ReaxFF Molecular Dynamics Investigation. ACS Omega 2024, 9, 30, 33153-33161

(5) A New Model of Carbon Nitride as a Substrate to Support Single Metal Atom. The Journal of Physical Chemistry C 2024, 128 (17), 7106-7114.

(6) Activation of waste tire pyrolysis carbon black by simulated fuel gas. Fullerenes, Nanotubes and Carbon Nanostructures 2023, 31 (8), 766-774.

(7) Molecular-Level Insights into Adsorption and Diffusion Properties of CO and CO2 on Pt-Supported Graphene. The Journal of Physical Chemistry C 2023, 127 (32), 16117-16124.

(8) Machine Learning-Assisted Exploration of a Two-Dimensional Nanoslit for Blast Furnace Gas Separation. Industrial & Engineering Chemistry Research 2023, 62 (43), 17974-17985.

(9) Effect of Cross‐Linked Structures on Mechanical Properties of Styrene‐Butadiene Rubber via Molecular Dynamics Simulation. Macromolecular Theory and Simulations 2022, 31 (2), 2100054.

(10) Formation Mechanism of Monocyclic Aromatic Hydrocarbons during Pyrolysis of Styrene Butadiene Rubber in Waste Passenger Car Tires. ACS Omega 2022, 7 (47), 42890-42900.

(11) Pd-Co alloy supported on TiO2 with oxygen vacancies for efficient N2 and O2 electrocatalytic reduction. Applied Surface Science 2021, 567, 150680.

(12) Curvature effects on electric-double-layer capacitance. Chinese Journal of Chemical Engineering 2021, 31, 145-152.

(13) Pyrolysis of vulcanized styrene-butadiene rubber via ReaxFF molecular dynamics simulation. Chinese Journal of Chemical Engineering 2021, 31, 94-102.

(14) Sintering Rate and Mechanism of Supported Pt Nanoparticles by Multiscale Simulation. Langmuir 2021, 37 (43), 12529-12538.

(15) Meso-scale simulation on mechanism of Na+-gated water-conducting nanochannels in zeolite NaA. Journal of Membrane Science 2021, 635, 119462.

(16) Machine-learning-accelerated screening of hydrogen evolution catalysts in MBenes materials. Applied Surface Science 2020, 526, 146522.

(17) A generalized formula for two-dimensional diffusion of CO in graphene nanoslits with different Pt loadings. Green Energy & Environment 2020, 5 (3), 322-332.

(18) Palladium dimer supported on Mo2CO2 (MXene) for direct methane to methanol conversion. Advanced Theory and Simulations 2019, 2 (2), 1800158.

(19) Multiscale simulation of morphology evolution of supported Pt nanoparticles via interfacial control. Langmuir 2019, 35 (19), 6393-6402.

(20) Single and double boron atoms doped nanoporous C2N–h2D electrocatalysts for highly efficient N2 reduction reaction: a density functional theory study. Nanotechnology 2019, 30 (33), 335403.

第一作者论文

1. Sintering Kinetics and Interfacial Heat Transfer Process of Binary Alloy Nanoparticles Catalysts: Molecular Dynamics Simulation. Industrial & Engineering Chemistry Research 2024, 63, 30, 13356–13365

2.  Molecular dynamics simulation of strained controlled gas diffusion in polyimide membranes. Materials Today Communications 2024, 38, 108099.

3. Tunable mechanical properties of vulcanised styrene-butadiene rubber by regulating cross-linked molecular network structures. MolecularSimulation 2023, 49 (1), 133-140.

4. Molecular dynamics simulation of molecular network structure and mechanical properties of polymer matrix in PBT propellant. Materials Today Communications 2023, 35, 105723.

5.  Size-dependent interfacial thermal transport in supported platinum nanocatalysts. Chemical Engineering Science 2023, 269, 118456.

6.  Multiscale simulation on product distribution from pyrolysis of styrene-butadiene rubber. Polymers 2019, 11 (12), 1967.

7.  Micromechanical simulation of the pore size effect on the structural stability of brittle porous materials with bicontinuous morphology. Physical Chemistry Chemical Physics 2019, 21 (24), 12895-12904.

8.  Multiscale simulation on thermal stability of supported metal nanocatalysts. Wiley Interdisciplinary Reviews: Computational Molecular Science 2019, 9 (4), e1405.

9.   A strain-controlled C2N monolayer membrane for gas separation in PEMFC application. Applied Surface Science 2018, 441, 408-414.

10.  Multiscale simulation of branched nanofillers on young’s modulus of polymer nanocomposites. Polymers 2018, 10 (12), 1368.

11.  Size‐dependent mechanical properties of glassy polymer nanofibers via molecular dynamics simulations. Journal of Polymer Science Part B: Polymer Physics 2017, 55 (6), 506-514.

12.  Tensile deformation of semi-crystalline polymers by molecular dynamics simulation. Iranian Polymer Journal 2017, 26, 903-911.

13.  Multiscale simulation of shear-induced mechanical anisotropy of binary polymer blends. RSC advances 2016, 6 (48), 41734-41742.

14.  聚合物材料力学性能的计算机模拟. 化工学报 2015, 66 (8), 2767.

15.  嵌段共聚物相容剂对聚合物共混体系力学性能影响的连续介观模拟. 物理化学学报 2014, 30 (12), 2241-2248.

16.  Mechanical properties of high-performance elastomeric nanocomposites: a sequential mesoscale simulation approach. RSC Advances 2014, 4 (108), 63586-63595.

17.  Micromechanical simulation of molecular architecture and orientation effect on deformation and fracture of multiblock copolymers. Polymer 2014, 55 (18), 4776-4785.

18.  Deformation and fracture of polystyrene/polypropylene blends: a simulation study. Polymer 2011, 52 (24), 5681-5694.

中国化工学会过程模拟及仿真专业委员会青年委员