Zijing Lin

发表

Heat transfer in the dynamic cycling of lithium–titanate batteries

Jinhua Sun, Qingsong Wang, Zijing Lin, 2016 .

Theoretical models for effective electrical and electrochemical properties of nano-particle infiltrated electrode of solid oxide fuel cell

Zijing Lin, Meina Chen, 2014 .

Property models and theoretical analysis of novel solid oxide fuel cell with triplet nano-composite electrode

Zijing Lin, Meina Chen, Ce Song, 2014 .

Theoretical model for surface diffusion driven Ni-particle agglomeration in anode of solid oxide fuel cell

Zijing Lin, Shengtao Gao, Jiayu Li, 2014 .

The influence of interconnect ribs on the performance of planar solid oxide fuel cell and formulae for optimal rib sizes

Zijing Lin, Jiayu Li, W. Kong, 2012 .

Percolation theory to predict effective properties of solid oxide fuel-cell composite electrodes

Robert J. Kee, Zijing Lin, Daifen Chen, 2009 .

The effects of the interconnect rib contact resistance on the performance of planar solid oxide fuel cell stack and the rib design optimization

Ce Song, Zijing Lin, Zijing Lin, 2008 .

LDA and GGA calculations of alkali metal adsorption at the (001) surface of MgO

M. Gutowski, Zijing Lin, J. A. Snyder, 2000 .

Optimization Design of Rib Width and Performance Analysis of Solid Oxide Electrolysis Cell

Zijing Lin, Meiting Guo, Xiao Ru, 2020, Energies.

Maximum Thermodynamic Electrical Efficiency of Fuel Cell System and Results for Hydrogen, Methane, and Propane Fuels

Zijing Lin, Xiao Ru, R. Mao, 2018 .

Comprehensive conformational studies of five tripeptides and a deduced method for efficient determinations of peptide structures.

Alexander D. MacKerell, X. Liu, Zijing Lin, 2012, The journal of physical chemistry. B.

Gas Phase Conformations of Tetrapeptide Glycine-Phenylalanine-Glycine-Glycine

Zijing Lin, Huibin Chen, Yao Wang, 2012 .

Performances of Five Representative Force Fields on Gaseous Amino Acids with Different Termini

Zijing Lin, Xin Chen, 2016 .

Local Structures and Chemical Properties of Deprotonated Arginine

Yi Luo, Zijing Lin, Hongbao Li, 2012 .

The role of dimerization on the structure transformation of arginine in gas phase

Yi Luo, Zijing Lin, Hongbao Li, 2014 .

Gas-phase IR spectroscopy of deprotonated amino acids: Global or Local minima?

Yi Luo, Zijing Lin, Hongbao Li, 2014 .

Conformations and Metal Ion Affinities of Glutamine Binding with Alkali and Alkaline Earth Metal Cations: an ab initio Study

Zijing Lin, Rui Pang, 2014 .

A fragment based step-by-step strategy for determining the most stable conformers of biomolecules

Yi Luo, Zijing Lin, Hongbao Li, 2014 .

A finite element analysis modeling tool for solid oxide fuel cell development: coupled electrochemistry, thermal and flow analysis in MARC®

M. Khaleel, Zijing Lin, Prabhakar Singh, 2004 .

Extensive computational study on coordination of transition metal cations and water molecules to glutamic acid.

Zijing Lin, Rui Pang, Lingbiao Meng, 2012, The journal of physical chemistry. A.

Efficient Mass Transport and Electrochemistry Coupling Scheme for Reliable Multiphysics Modeling of Planar Solid Oxide Fuel Cell Stack

Ang Li, Zijing Lin, Ang Li, 2017 .

Effects of electrode composition on the electrochemical performance and mechanical property of micro-tubular solid oxide fuel cell

Zijing Lin, Jiayu Li, 2012 .

A key geometric parameter for the flow uniformity in planar solid oxide fuel cell stacks

Wuxi Bi, Zijing Lin, Daifen Chen, 2009 .

Three-dimensional modeling of planar solid oxide fuel cells and the rib design optimization

Wei Kong, Zijing Lin, Zijing Lin, 2009 .

Adsorption of CO on MgO supported alkali monolayers: a periodic density functional local density approximation and generalized gradient approximation study

M. Gutowski, Zijing Lin, J. A. Snyder, 2000 .

Multi-Physics Modeling of Solid Oxide Fuel Cell Fueled by Methane and Analysis of Carbon Deposition

Zijing Lin, Bao-xuan Wang, Zhu Jiang, 2015 .

First-principles study on core-level spectroscopy of arginine in gas and solid phases.

Yi Luo, Zijing Lin, Weijie Hua, 2012, The journal of physical chemistry. B.

Degradations of the electrochemical performance of solid oxide fuel cell induced by material microstructure evolutions

Zijing Lin, Jiang Zhu, 2018, Applied Energy.

Atomistic insight into the hydration and proton conducting mechanisms of the cobalt doped Ruddlesden-Popper structure Sr3Fe2O7-δ

F. Zhang, Zijing Lin, Meina Chen, 2020 .

A scheme for the generation of Fe–P networks to search for low-energy LiFePO4 crystal structures

C. Wang, K. Ho, Caizhuang Wang, 2017 .

Parametric study of kW-class solid oxide fuel cell stacks fueled by hydrogen and methane with fully multiphysical coupling model

Zijing Lin, Meiting Guo, G. Xiao, 2021 .

Structural stabilities of metalated histidines in gas phase and existence of gaseous zwitterionic histidine conformers

Zijing Lin, Zhiwen Lu, A. K. Rai, 2009 .

Unlocking the nature of the co-doping effect on the ionic conductivity of CeO2-based electrolyte

M. Ni, Zijing Lin, Meina Chen, 2019, Ceramics International.

Numerical study on the mechanical stress and mechanical failure of planar solid oxide fuel cell

Zijing Lin, Xiu-rong Fang, 2018, Applied Energy.

Theoretical Modeling for Fundamental Understanding of High-Temperature Solid Oxide Fuel Cells

Zijing Lin, 2015 .

A Schottky barrier based model for the grain size effect on oxygen ion conductivity of acceptor-doped ZrO2 and CeO2

Zijing Lin, B. Wang, 2014 .

Exploration of tetrahedral structures in silicate cathodes using a motif-network scheme

K. Ho, Caizhuang Wang, Xin Zhao, 2015, Scientific Reports.

Extensive exploration of the conformational landscapes of neutral and terminally blocked prolines in the gas phase: A density functional theory study

Zijing Lin, Yizhou Yang, 2022, Journal of Chemical Research.

Theoretical spectroscopic studies on chemical and electronic structures of arginylglycine.

Yi Luo, Zijing Lin, Jun Jiang, 2015, Physical chemistry chemical physics : PCCP.

Analysis of the Sidechain Structures of Amino Acids and Peptides and a Deduced Method for the Efficient Search of Peptide Conformations

Zijing Lin, Bowen Yuan, Xiaoya Ru, 2022, SSRN Electronic Journal.

Effects of methane steam reforming on the mechanical stability of solid oxide fuel cell stack

L. Yang, M. Ni, Zijing Lin, 2022, Applied Energy.

Electronic structures and electron detachment energies of halogen substituted acetate anions, XCH2COO- (X=F,Cl,Br).

Zijing Lin, Wenbo Yu, Chuanfan Ding, 2007, The Journal of chemical physics.

A Simple Scheme for Studies of Surface Phonons of Covalent Semiconductors. I. Calculation of Force Constants

Zijing Lin, Ke-lin Wang, 1988 .

Complexations of alkali/alkaline earth metal cations with gaseous glutamic acid

Zijing Lin, Lingbiao Meng, 2014 .

Deposition and growth kinetics studies of thin zirconium dioxide films by UVILS-CVD

Zijing Lin, Xinyu Zhang, I. Boyd, 2007 .

Combining classical molecular docking with self-consistent charge density-functional tight-binding computations for the efficient and quality prediction of ligand binding structure

Zijing Lin, Amar Y Al-Ansi, Haorui Lu, 2022, Journal of Chemical Research.

Comprehensive computational study of gas-phase conformations of neutral, protonated and deprotonated glutamic acids

Zijing Lin, Lingbiao Meng, 2011 .

A Simple Scheme for Studies of Surface Phonons of Covalent Semiconductors. II. Surface Phonons at Ideal and Relaxed Si(110) Surface

Zijing Lin, Ke-lin Wang, 1988 .

Catalytic Effect of Hydrogen Bond on Oxhydryl Dehydrogenation in Methanol Steam Reforming on Ni(111)

Zijing Lin, C. Ke, 2020, Molecules.

Density Functional Theory Based Micro- and Macro-Kinetic Studies of Ni-Catalyzed Methanol Steam Reforming

Zijing Lin, C. Ke, 2020, Catalysts.

Energetics, structures, vibrational frequencies, VA, VCD and Raman intensities ofLeuE

C. Baldauf, K. Jalkanen, Zijing Lin, 2017 .

Systematic ab initio studies of the conformers and conformational distribution of gas-phase tyrosine.

Zijing Lin, Zijing Lin, Zhijian Huang, 2005, The Journal of chemical physics.

Ab initio studies of aspartic acid conformers in gas phase and in solution.

Zijing Lin, Zijing Lin, Mingliang Chen, 2007, The Journal of chemical physics.

Electronic structures of intermolecular hydrogen bond contacts with solute in aqueous solution: glycine as a working prototype.

Weidong Wu, Zijing Lin, Lingbiao Meng, 2016, Physical chemistry chemical physics : PCCP.

Comprehensive ab initio study on the conformations of L-Threonine and L-allo-Threonine and related species in gas phase

Zijing Lin, Xuee Xu, 2010 .

How to Look for Compounds: Predictive Screening and in situ Studies in Na−Zn−Bi System

K. Ho, Zijing Lin, Weiyi Xia, 2021, Chemistry.

Computational study on single molecular spectroscopy of tyrosin-glycine, tryptophane-glycine and glycine-tryptophane

Zijing Lin, Shixue Liu, Bing‐Hui Yang, 2017, Scientific Reports.

A semi-empirical and ab initio combined approach for the full conformational searches of gaseous lysine and lysine–H2O complex

Ce Song, Zijing Lin, Zijing Lin, 2008 .

Thorough theoretical search of conformations of neutral, protonated and deprotonated glutamine in gas phase

Sanliang Ling, Zijing Lin, Minghao Guo, 2013 .

Conformational search for zwitterionic leucine and hydrated conformers of both the canonical and zwitterionic leucine using the DFT-CPCM model

Zijing Lin, Xuee Xu, A. K. Rai, 2011 .

An exploration of conformational search of leucine molecule and their vibrational spectra in gas phase using ab initio methods.

Zijing Lin, Ce Song, A. K. Rai, 2009, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Graph deep learning accelerated efficient crystal structure search and feature extraction

Zijing Lin, Chuan-nan Li, S. Wei, 2023, npj Computational Materials.

A comparative study of Sm networks in Al-10 at.%Sm glass and associated crystalline phases

K. Ho, Caizhuang Wang, Zijing Lin, 2018 .

Long-term evolution of mechanical performance of solid oxide fuel cell stack and the underlying mechanism

Zijing Lin, Meiting Guo, 2021, International Journal of Hydrogen Energy.

Effects of Electrode Composition and Thickness on the Mechanical Performance of a Solid Oxide Fuel Cell

Zijing Lin, Jiang Zhu, Xiurong Fang, 2018, Energies.

Theoretical studies on the electrochemical and mechanical properties and microstructure optimization of micro-tubular solid oxide fuel cells

Zijing Lin, Jiayu Li, W. Kong, 2013 .

Analytical Solutions of the Two-Site Holstein Model by the Coherent State Expansion

W. Kelin, Zijing Lin, Rongsheng Han, 2003 .

Theoretical search for possible Li–Ni–B crystal structures using an adaptive genetic algorithm

K. Ho, Caizhuang Wang, Xin Zhao, 2020, Journal of Applied Physics.

Prediction of crystal structures and motifs in the Fe–Mg–O system at Earth’s core pressures

K. Ho, Caizhuang Wang, Shunqing Wu, 2021, New Journal of Physics.

Continuum scale modelling and complementary experimentation of solid oxide cells

Stephen J. McPhail, Bengt Sundén, Meng Ni, 2021, Progress in Energy and Combustion Science.

Three-Dimensional Activity Volcano Plot under an External Electric Field

Zijing Lin, C. Ke, Shih-Hung Liu, 2022, ACS Catalysis.

Multiscale Catalyst Design for Steam Methane Reforming Assisted by Deep Learning

Zijing Lin, Shixue Liu, Xiao Ru, 2021 .

A Microscale Modeling Tool for the Design and Optimization of Solid Oxide Fuel Cells

Zijing Lin, Wei Kong, Shixue Liu, 2009 .

A modified dusty gas model in the form of a Fick's model for the prediction of multicomponent mass transport in a solid oxide fuel cell anode

Zijing Lin, W. Kong, Huayang Zhu, 2012 .

Gaseous arginine conformers and their unique intramolecular interactions.

Zijing Lin, Wenbo Yu, Maciej Gutowski, 2006, The journal of physical chemistry. A.

Numerical study on lithium titanate battery thermal response under adiabatic condition

Jinhua Sun, Qingsong Wang, Zijing Lin, 2015 .

First-principle studies of gaseous aromatic amino acid histidine

Zijing Lin, Wenbo Yu, Zijing Lin, 2006 .

Coexistence of dihydrogen, blue- and red-shifting hydrogen bonds in an ultrasmall system: valine.

Zijing Lin, Wenbo Yu, Zijing Lin, 2006, Chemphyschem : a European journal of chemical physics and physical chemistry.

Effects of microsolvation and aqueous solvation on the tautomers of histidine: a computational study on energy, structure and IR spectrum

Zijing Lin, Zhiwen Lu, A. K. Rai, 2009 .

Machine-learning accelerated annealing with fitting-search style for multicomponent alloy structure predictions

Zijing Lin, Yifeng Duan, H. Liang, 2023, Physical Review Materials.

A localized-basis scheme for molecular dynamics

Zijing Lin, J. Harris, 1993 .

Geometric Design of Anode-Supported Micro-Tubular Solid Oxide Fuel Cells by Multiphysics Simulations

Zijing Lin, Hongbo Shi, Jiang Zhu, 2017 .

Detailed ab initio studies of the conformers and conformational distributions of gaseous tryptophan.

Zijing Lin, Zijing Lin, Zhijian Huang, 2005, The journal of physical chemistry. A.

A theoretical model for the electrical conductivity of core–shell nano-composite electrode of SOFC

Zijing Lin, Meina Chen, Du Liu, 2014 .

Uncovering the Enhancement Mechanism of the Oxygen Reduction Reaction on Perovskite/Ruddlesden-Popper Oxide Heterostructures (Nd,Sr)CoO3/(Nd,Sr)2CoO4 and (Nd,Sr)CoO3/(Nd,Sr)3Co2O7.

L. Bi, Zijing Lin, Meina Chen, 2023, The journal of physical chemistry letters.

Stabilizing the crystal structures of NaFePO4 with Li substitutions.

K. Ho, Caizhuang Wang, Xin Zhao, 2020, Physical chemistry chemical physics : PCCP.

Computational Exploration of Conformations of Glycine-Arginine and a Deduced Model on Global Minimum Configurations of Dipeptides in Gas Phase

Zijing Lin, Kai Yang, Bing‐Hui Yang, 2015 .

Elementary reaction pathway study and a deduced macrokinetic model for the unified understanding of Ni-catalyzed steam methane reforming

Zijing Lin, C. Ke, 2020 .

A multiphysics fully coupled modeling tool for the design and operation analysis of planar solid oxide fuel cell stacks

Ce Song, Zijing Lin, Ang Li, 2017 .

Systematic search of conformations of five tetrapeptides and a divide and conquer strategy for the predictions of peptide structures

Zijing Lin, Zijing Lin, Bing‐Hui Yang, 2017 .

Extensive Computational Study on Conformations of Microsolvated Leucine Complexes

Zijing Lin, An-dong Hu, Shans‐Bin Liu, 2012 .

Ab initio studies of gas phase asparagine conformers

Zijing Lin, Zijing Lin, Zhijian Huang, 2005 .

Exploration of the full conformational landscapes of gaseous aromatic amino acid phenylalanine: An ab initio study

Zijing Lin, Wenbo Yu, Zijing Lin, 2006 .

NWChem: Past, present, and future.

Jeffery S. Boschen, Nicholas P. Bauman, T. Straatsma, 2020, The Journal of chemical physics.

Gaussian-basis LDA and GGA calculations for alkali-metal equations of state

Zijing Lin, J. Jaffe, A. Hess, 1998 .

MDO: A Computational Protocol for Accurate Prediction of Full Flexibility Receptor-Ligand Binding Mode Structures

Zijing Lin, Amar Y. Al-Ansi, 2021 .

Multi-physics modeling assisted design of non-coking anode for planar solid oxide fuel cell fueled by low steam methane

Zijing Lin, Bao-xuan Wang, Jiang Zhu, 2018, Chinese Journal of Chemical Physics.

A theoretical framework for multiphysics modeling of methane fueled solid oxide fuel cell and analysis of low steam methane reforming kinetics

Zijing Lin, Zijing Lin, Bao-xuan Wang, 2016 .

The effect of interconnect rib size on the fuel cell concentration polarization in planar SOFCs

Mohammad A. Khaleel, Zijing Lin, Jeffry W. Stevenson, 2003 .

Combined micro-scale and macro-scale modeling of the composite electrode of a solid oxide fuel cell

Wei Kong, Wuxi Bi, Zijing Lin, 2010 .

Periodic Density Functional LDA and GGA Study of CO Adsorption at the (001) Surface of MgO

M. Gutowski, Zijing Lin, A. Hess, 2000 .

Comparison of some representative density functional theory and wave function theory methods for the studies of amino acids

Maciej Haranczyk, Wenbo Yu, Lei Liang, 2009, J. Comput. Chem..

A genetic algorithm encoded with the structural information of amino acids and dipeptides for efficient conformational searches of oligopeptides

Xiao Ru, Ce Song, Zijing Lin, 2016, J. Comput. Chem..

A random forest learning assisted “divide and conquer” approach for peptide conformation search

Bing Yang, Xin Chen, Zijing Lin, 2018, Scientific Reports.

Theoretical prediction of a highly responsive material: Spin fluctuations and superconductivity in FeNiB2 system

K. Ho, Caizhuang Wang, Zijing Lin, 2019, Applied Physics Letters.

Fe-Si networks and charge/discharge-induced phase transitions in Li2FeSiO4 cathode materials.

Caizhuang Wang, Xin Zhao, Shunqing Wu, 2018, Physical chemistry chemical physics : PCCP.

Flow uniformity optimization for large size planar solid oxide fuel cells with U-type parallel channel designs

Wuxi Bi, Jiayu Li, Zijing Lin, 2010 .

Computational study on single molecular spectroscopy of tyrosin-glycine, tryptophane-glycine and glycine-tryptophane

Zijing Lin, Shixue Liu, Bing‐Hui Yang, 2017, Scientific Reports.