| 公開日期 | 標題 | 作者 | 來源出版物 | scopus | WOS | 全文 |
1 | 2024 | Corrosion protection: Now and future | SHIANG-TAI LIN | Journal of the Taiwan Institute of Chemical Engineers | | | |
2 | 2024 | Rigorous simulation and comprehensive analysis for the novel glycerol carbonate (GC) production process via indirect conversion of CO2 | Wu, Pei Jhen; Hsu, Chun Cheng; BOR-YIH YU ; SHIANG-TAI LIN | Fuel | 1 | | |
3 | 2024 | Can local composition models combined with global renormalization group theory describe the phase transitions in ferromagnetic materials? | Shih, Yen Jen; SHIANG-TAI LIN | Fluid Phase Equilibria | 0 | | |
4 | 2023 | MARS Plus: An Improved Molecular Design Tool for Complex Compounds Involving Ionic, Stereo, and Cis-Trans Isomeric Structures | Huang, Chen Hsuan; SHIANG-TAI LIN | Journal of Chemical Information and Modeling | | | |
5 | 2023 | Entropy of different phases formed by soft rods | Chattopadhyay, Jayeeta; SHIANG-TAI LIN ; Maiti, Prabal K. | Journal of Chemical Physics | 0 | 0 | |
6 | 2023 | Phase behavior of active and passive dumbbells | Venkatareddy, Nayana; SHIANG-TAI LIN ; Maiti, Prabal K. | Physical Review E | 4 | 2 | |
7 | 2023 | Evaluation of thermophysical data, COSMO-SAC predictions, and feed simplifications for aromatic extraction process simulation using ionic liquid [EMIM][NTf2] | Tsai, Chang Che; McNeeley, Adam; SHIANG-TAI LIN ; Liu, Y. A. | AIChE Journal | 2 | 0 | |
8 | 2023 | Development of energy-optimum aromatic extraction processes using ionic liquid [EMIM][NTf2] | McNeeley, Adam; Tsai, Chang Che; SHIANG-TAI LIN ; Liu, Y. A. | AIChE Journal | 2 | 3 | |
9 | 2023 | Science-guided data analytics for selecting ionic liquid solvents for aromatic extraction | McNeeley, Adam; Tsai, Chang Che; SHIANG-TAI LIN ; Liu, Y. A. | AIChE Journal | 3 | 3 | |
10 | 2022 | Modeling of phase separation solvent for CO2 capture using COSMO-SAC model | Hung Y.-C; Hsieh C.-M; Machida H; SHIANG-TAI LIN ; Shimoyama Y. | Journal of the Taiwan Institute of Chemical Engineers | 2 | 2 | |
11 | 2022 | Phase equilibrium modeling of mixtures containing conformationally flexible molecules with the COSMO-SAC model | Hung Y.-C; Hsieh C.-M; Machida H; SHIANG-TAI LIN ; Shimoyama Y. | Journal of Molecular Liquids | 3 | 1 | |
12 | 2021 | Novel Donor-Electret-Acceptor Framework for Higher Charge Transfer and Distance of Charge Transfer through Dipole Engineering | Vikramaditya T; Lin S.-T.; SHIANG-TAI LIN | Journal of Physical Chemistry C | | | |
13 | 2021 | Unveiling the mechanism of CO2-driven phase change in amine + water + glycol ether ternary mixture | Hung Y.-C; Hsieh C.-M; Machida H; Lin S.-T; Shimoyama Y.; SHIANG-TAI LIN | Journal of the Taiwan Institute of Chemical Engineers | | | |
14 | 2021 | Promotion mechanism for the growth of CO2hydrate with urea using molecular dynamics simulations | Wang P.-W; Wu D.T; Lin S.-T.; SHIANG-TAI LIN | Chemical Communications | 15 | | |
15 | 2021 | A robust and automated approach for the calculation of absolute entropy from the two-phase thermodynamic model with Gaussian memory function | Lin M.-H; Lin S.-T.; SHIANG-TAI LIN | Springer Series in Materials Science | | | |
16 | 2021 | Towards design of phase separation solvent for CO2 capture using COSMO-SAC model | Hung Y.-C; Hsieh C.-M; Machida H; Lin S.-T; Shimoyama Y.; SHIANG-TAI LIN | Journal of Molecular Liquids | | | |
17 | 2021 | Screening of CO2 utilization routes from process simulation: Design, optimization, environmental and techno-economic analysis | Lee C.-T; Tsai C.-C; Wu P.-J; BOR-YIH YU ; Lin S.-T.; SHIANG-TAI LIN | Journal of CO2 Utilization | | | |
18 | 2020 | Prediction of the equilibrium conditions of clathrate hydrates using updated pressure dependence of the langmuir adsorption constant in the van der Waals-Platteeuw model | Hsieh M.-K; Lin S.-T; Chen L.-J.; SHIANG-TAI LIN | AIChE Annual Meeting, Conference Proceedings | | | |
19 | 2020 | Evaluating the direct CO2 to diethyl carbonate (DEC) process: Rigorous simulation, techno-economical and environmental evaluation | BOR-YIH YU ; Wu, P.-J.; Tsai, C.-C.; Lin, S.-T.; SHIANG-TAI LIN | Journal of CO2 Utilization | | | |
20 | 2020 | Computer-aided molecular design for chemical and energy applications | Huang C.-H; Lin S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting, Conference Proceedings | | | |
21 | 2020 | First-principles prediction of solid solute solubility in supercritical carbon dioxide using PR+COSMOSAC EOS | Cai, Z.-Z.; Liang, H.-H.; Chen, W.-L.; Lin, S.-T.; Hsieh, C.-M.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
22 | 2020 | 電腦輔助分子設計在特用化學品開發上的應用 | 黃晨軒; 林祥泰 | 化工 | | | |
23 | 2020 | Effect of small cage guests on dissociation properties of tetrahydrofuran hydrates | Chang, K.-Y.; Chu, C.-K.; Chu, L.-S.; Chen, Y.-A.; Lin, S.-T.; Chen, Y.-P.; Chen, L.-J.; SHIANG-TAI LIN ; YAN-PING CHEN | Journal of Physical Chemistry B | 2 | 2 | |
24 | 2020 | 化學工程學系課程與教學在人工智慧發展下的因應與演進 | 汪上曉; 林祥泰; 康嘉麟; 陳榮輝; 陳信文; 陳志銘; 林祥泰 | 化工 | | | |
25 | 2020 | Accurate Prediction of Vertical Emission from Excited-State Tuning of Range-Separated Density Functional Theory | Vikramaditya, T.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Physical Chemistry C | | 6 | |
26 | 2020 | Extended Pitzer-Debye-H?ckel Model for Long-Range Interactions in Ionic Liquids | Chang, C.-K.; SHIANG-TAI LIN | Journal of Chemical and Engineering Data | 17 | 14 | |
27 | 2020 | Improved Prediction of Phase Behaviors of Ionic Liquid Solutions with the Consideration of Directional Hydrogen Bonding Interactions | Chang, C.-K.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
28 | 2020 | Integration of modern computational chemistry and ASPEN PLUS for chemical process design | Tsai, C.-C.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Journal | | | |
29 | 2020 | A Benchmark Open-Source Implementation of COSMO-SAC | Bell, I.H.; Mickoleit, E.; Hsieh, C.-M.; Lin, S.-T.; Vrabec, J.; Breitkopf, C.; J?ger, A.; SHIANG-TAI LIN | Journal of Chemical Theory and Computation | 71 | 59 | |
30 | 2019 | Theory and Kinetic Monte Carlo Simulation of Guest Molecule Transport in sI Clathrate Hydrates Based on Cage Hopping | Chu L.-S.; Wu D.T.; Lin S.-T. | Journal of Physical Chemistry C | 3 | 3 | |
31 | 2019 | Improvement to PR+COSMOSAC EOS for Predicting the Vapor Pressure of Nonelectrolyte Organic Solids and Liquids | Liang H.-H.; Li J.-Y.; Wang L.-H.; Lin S.-T. ; Hsieh C.-M. | Industrial and Engineering Chemistry Research | 17 | 17 | |
32 | 2019 | Efficient Computation of Entropy and Other Thermodynamic Properties for Two-Dimensional Systems Using Two-Phase Thermodynamic Model | Pannir Sivajothi S.S.; Lin S.-T. ; Maiti P.K. | Journal of Physical Chemistry B | 7 | 7 | |
33 | 2019 | New Data Structure for Computational Molecular Design with Atomic or Fragment Resolution | Hsu, H.-H.; Huang, C.-H.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Chemical Information and Modeling | | | |
34 | 2019 | Stable, color-tunable 2D SCN-based perovskites: Revealing the critical influence of an asymmetric pseudo-halide on constituent ions | Li C.-H.; Tsai C.-C.; Liao M.-Y.; Su Y.-A.; SHIANG-TAI LIN ; CHU-CHEN CHUEH | Nanoscale | 21 | 19 | |
35 | 2019 | 應用狀態方程式預測藥物在超臨界二氧化碳的溶解度 | 蔡宗哲; 謝介銘; 梁興豪; 林祥泰 | 化工 | | | |
36 | 2019 | 化工熱力學的新發展專輯前言 | 林祥泰 | 化工 | | | |
37 | 2019 | 以深度學習模型預測量子力學性質及活性係數 | 章絜鈞; 汪上曉; 康嘉麟; 許軒豪; 黃承軒; 林祥泰 | 化工 | | | |
38 | 2019 | 全自動熱力學物性預測與程序設計上的應用 | 余柏毅; 蔡昌哲; 林祥泰 | 化工 | | | |
39 | 2019 | Prediction and Reasoning for the Occurrence of Lower Critical Solution Temperature in Aqueous Solution of Ionic Liquids | Tsai Y.-R.; Lin S.-T. | Industrial & Engineering Chemistry Research | 6 | 5 | |
40 | 2019 | A new approach for developing exact local composition models for lattice fluids | Liu T.-C.; Lin S.-T. | Journal of the Taiwan Institute of Chemical Engineers | 2 | 1 | |
41 | 2019 | Limitations of Global Hybrids in Predicting the Geometries and Torsional Energy Barriers of Dimeric Systems and the Role of Hartree Fock and DFT Exchange | Vikramaditya, T.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Computational Chemistry | | | |
42 | 2019 | Exact Local Composition Model for Two-Dimensional Lattice Fluids | Liu, T.-C.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
43 | 2018 | SkaSim – Scalable HPC Software for Molecular Simulation in the Chemical Industry [SkaSim – Skalierbare HPC-Software f?r molekulare Simulationen in der chemischen Industrie] | Vrabec, J.; Bernreuther, M.; Bungartz, H.-J.; Chen, W.-L.; Cordes, W.; Fingerhut, R.; Glass, C.W.; Gmehling, J.; Hamburger, R.; Heilig, M.; Heinen, M.; Horsch, M.T.; Hsieh, C.-M.; H?lsmann, M.; J?ger, P.; Klein, P.; Knauer, S.; K?ddermann, T.; K?ster, A.; Langenbach, K.; Lin, S.-T.; Neumann, P.; Rarey, J.; Reith, D.; Rutkai, G.; Schappals, M.; Schenk, M.; Schedemann, A.; Sch?nherr, M.; Seckler, S.; Stephan, S.; St?bener, K.; Tchipev, N.; Wafai, A.; Werth, S.; SHIANG-TAI LIN ; Lin S.-T. | Chemie-Ingenieur-Technik | 5 | 5 | |
44 | 2018 | Improved Directional Hydrogen Bonding Interactions for the Prediction of Activity Coefficients with COSMO-SAC | Chang C.-K.; Chen W.-L.; Wu D.T.; Lin S.-T. | Industrial and Engineering Chemistry Research | 15 | 12 | |
45 | 2018 | Prediction of Gas and Liquid Solubility in Organic Polymers Based on the PR+COSMOSAC Equation of State | Wang L.-H.; Hsieh C.-M.; Lin S.-T. | Industrial and Engineering Chemistry Research | 6 | 6 | |
46 | 2018 | Fully Automated Molecular Design with Atomic Resolution for Desired Thermophysical Properties | Hsu H.-H.; Huang C.-H.; Lin S.-T. | Industrial and Engineering Chemistry Research | 4 | 3 | |
47 | 2018 | Prediction of solid-liquid-gas equilibrium for binary mixtures of carbon dioxide + organic compounds from approaches based on the COSMO-SAC model | Chen C.-Y.; Wang L.-H.; Hsieh C.-M.; Lin S.-T. | Journal of Supercritical Fluids | 9 | 9 | |
48 | 2018 | Impact of non-empirically tuning the range-separation parameter of long-range corrected hybrid functionals on ionization potentials, electron affinities, and fundamental gaps | Vikramaditya, T.; Chai, J.-D.; JENG-DA CHAI ; SHIANG-TAI LIN | Journal of Computational Chemistry | 10 | 10 | |
49 | 2018 | Equilibrium and Transport Properties of Methane at the Methane/Water Interface with the Presence of SDS | Lin Z.-Y.; Wu D.T.; Lin S.-T. | Journal of Physical Chemistry C | 15 | 13 | |
50 | 2018 | Measurements of diffusion coefficient of methane in water/brine under high pressure | Chen Y.-A.; Chu C.-K.; Chen Y.-P.; Chu L.-S.; Lin S.-T. ; Chen Y.-P. | Terrestrial, Atmospheric and Oceanic Sciences | 10 | 8 | |
51 | 2017 | The Origin of Ion-Pairing and Redissociation of Ionic Liquid | Lee B.-S.; Lin S.-T. | Journal of Physical Chemistry B | 16 | 16 | |
52 | 2017 | Assessing the role of Hartree-Fock exchange, correlation energy and long range corrections in evaluating ionization potential, and electron affinity in density functional theory | Vikramaditya, T.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Computational Chemistry | | | |
53 | 2017 | Development of Reservoir Engineering Technologies for the Exploitation of Natural Gas Hydrates | B.-Z. Hsieh; R.-M. Wu; D. S. Wong; W.-Y. Sean; M.-J. Lee; C.-S. Su; Y.-C. Liao; S.-T. Lin ; L.-J. Chen; Y.-P. Chen | | | | |
54 | 2017 | Artificial Intelligence for Molecular Design | S.-T. Lin | | | | |
55 | 2017 | Water Vacancy Driven Diffusion in Clathrate Hydrates: Molecular Dynamics Simulation Study | Lo H.; Lee M.-T.; Lin S.-T. | Journal of Physical Chemistry C | 22 | 21 | |
56 | 2017 | Molecular Dynamics Simulation for Defect Driven Phenomena: Diffusion of Guest Molecules & CO2-CH4 Replacement in Clathrate | M.-T. Lee; H. Lo; S.-T. Lin | | | | |
57 | 2017 | Coupled Geomechanics and Fluid Flow Modeling on Gas Production from Hydrate Deposits: A Case Study in Taiwan | Y. C. Chiu; C. Y. Wu; B. Z. Hsieh; S. T. Lin | | | | |
58 | 2017 | Mechanism of Gas Replacement in sI CH4-CO2 Hydrate System via Molecular Dynamics and Kinetic Monte Carlo Simulation | L.-S. Chu; S.-T. Lin | | | | |
59 | 2017 | A Comprehensive Assessment of COSMO-SAC Models for Predictions of Fluid Phase Equilibria | R. Fingerhut; W.-l. Chen; A. Schedemann; W. Cordes; J. Rarey; C.-m. Hsieh; S.-T. Lin ; J. Vrabec | | | | |
60 | 2017 | Atom-Based Computer-Aided Molecular Design with Genetic Algorithm and Simulated Annealing Algorithm | H.-H. Hsu; C.-H. Huang; S.-T. Lin | | | | |
61 | 2017 | Prediction and screening of solubility of pharmaceuticals in single- and mixed-ionic liquids using COSMO-SAC model | Lee B.-S.; Lin S.-T. | AIChE Journal | 27 | 23 | |
62 | 2017 | Explicit consideration of spatial hydrogen bonding direction for activity coefficient prediction based on implicit solvation calculations | Chen W.-L.; Lin S.-T. | Physical Chemistry Chemical Physics | 10 | 9 | |
63 | 2017 | Comprehensive Assessment of COSMO-SAC Models for Predictions of Fluid-Phase Equilibria | Fingerhut R.; Chen W.-L.; Schedemann A.; Cordes W.; Rarey J.; Hsieh C.-M.; Vrabec J.; Lin S.-T. | Industrial and Engineering Chemistry Research | 53 | 52 | |
64 | 2016 | Improved 2PT method for calculating thermodynamic properties from molecular dynamics simulations | M.-H. Lin; S.-T. Lin | | | | |
65 | 2016 | Measurement for the Dissociation Conditions of Methane and Carbon Dioxide Hydrate in the Presence of Additive Materials | Chen, Yan-Ping; Chen, Li-Jen; Lin, Shiang-Tai; LI-JEN CHEN ; SHIANG-TAI LIN ; YAN-PING CHEN | Mrs Advances | 2 | 0 | |
66 | 2016 | Chain length effect of ionic liquid 1-alkyl-3-methylimidazolium chloride on the phase equilibrium of methane hydrate | Chu, C.-K.; Lin, S.-T.; Chen, Y.-P.; Chen, P.-C.; LI-JEN CHEN ; Lin S.-T. ; Chen Y.-P. | Fluid Phase Equilibria | | | |
67 | 2016 | Mechanism for the Replacement of CH4 in Methane Hydrates with CO2 in the Solid Phase | H. Lo; S.-T. Lin | | | | |
68 | 2016 | Reservoir Engineering Simulation for Gas Hydrate Recovery Offshore Southwest Taiwan | S.-T. Lin | | | | |
69 | 2016 | The Refinement of COSMO-SAC Model for Associating Fluids | W.-L. Chen; S.-T. Lin | | | | |
70 | 2016 | Prediction of pH Effect on the Octanol-Water Partition Coefficient of Ionizable Pharmaceuticals | Chen C.-S.; Lin S.-T. | Industrial and Engineering Chemistry Research | 21 | 17 | |
71 | 2016 | Molecular dynamics study on the nucleation of methane + tetrahydrofuran mixed guest hydrate | Wu J.-Y.; CHEN, L. J. ; CHEN, Y. P. ; Lin S.-T. | Physical Chemistry Chemical Physics | 38 | 35 | |
72 | 2016 | Simultaneous Prediction of Dissociation and Phase Behaviors of Ionic Liquid Solutions | B.-S. Lee; S.-T. Lin | | | | |
73 | 2016 | Prediction of Gas Sorption Isotherms in Organic Polymer Systems by PR+COSMOSAC Equation of State | L.-H. Wang; S.-T. Lin | | | | |
74 | 2016 | A Novel Approach of Modeling Orientational Hydrogen Bonding Interactions in Associating Fluids with the COSMO-SAC Activity | W.-L. Chen; S.-T. Lin | | | | |
75 | 2016 | A novel multiscale approach for rapid prediction of phase behaviors with consideration of molecular conformations | Yang L.; Chang C.-W.; Lin S.-T. | AIChE Journal | 6 | 6 | |
76 | 2016 | A Critical Evaluation on the Performance of COSMO-SAC Models for Vapor-Liquid and Liquid-Liquid Equilibrium Predictions Based on Different Quantum Chemical Calculations | Chen W.-L.; Hsieh C.-M.; Yang L.; Hsu C.-C.; Lin S.-T. | Industrial and Engineering Chemistry Research | 54 | 48 | |
77 | 2015 | Molecular Dynamics Study on the Growth Mechanism of Methane plus Tetrahydrofuran Mixed Hydrates | Wu, J.-Y.; Chen, L.-J.; Chen, Y.-P.; LI-JEN CHEN ; SHIANG-TAI LIN ; Chen Y.-P. | Journal of Physical Chemistry C | 30 | 27 | |
78 | 2015 | Molecular dynamics study on the equilibrium and kinetic properties of tetrahydrofuran clathrate hydrates | Wu J.-Y.; CHEN, L. J. ; Chen Y.-P. ; LIN, S. T. | Journal of Physical Chemistry C | 32 | 33 | |
79 | 2015 | Nucleation and Growth of CH4+THF Mixed Guest Hydrates from Molecular Dynamic Simulations | J.-Y. Wu; S.-T. Lin | | | | |
80 | 2015 | Replacement of CH4 in Methane Hydrates with CO2: Some Insights from Molecular Dynamics Simulations | S.-T. Lin | | | | |
81 | 2015 | Inhibition effect of 1-ethyl-3-methylimidazolium chloride on methane hydrate equilibrium | Chu, C.-K.; Chen, P.-C.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Chemical Thermodynamics | | | |
82 | 2015 | Measurements for the equilibrium conditions of methane hydrate in the presence of cyclopentanone or 4-hydroxy-4-methyl-2-pentanone additives | Juan, Y.-W.; Tang, M.; Chen, L.-J. ; Lin, S.-T. ; Chen, P.-C.; Chen Y.-P. | Fluid Phase Equilibria | | | |
83 | 2015 | From First Principles to Fluid Phase Equilibria | S.-T. Lin | | | | |
84 | 2015 | Improved Prediction of Vapor Pressure for Pure Liquids and Solids from the PR+COSMOSAC Equation of State | Wang, L.-H.; Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
85 | 2015 | Assessment of density functional methods for exciton binding energies and related optoelectronic properties | JENG-DA CHAI ; Lin S.-T. | Rsc Advances | 46 | 39 | |
86 | 2015 | A Novel Multiscale Approach for Prediction of Thermodynamics Properties Based on Distribution of Molecular Conformations | L. Yang; C.-W. Chang; S.-T. Lin | | | | |
87 | 2015 | Prediction of Vapor and Sublimation Pressure for Pure Compounds from the Modified PR+Cosmosac Equation of State | L.-H. Wang; S.-T. Lin | | | | |
88 | 2015 | Can Molecular Dynamics Simulations Provide a Quantitative Description for the Rate of Methane Hydrate Dissociation? | H. Lo; S.-T. Lin | | | | |
89 | 2015 | Theoretical study on the torsional potential of alkyl, donor, and acceptor substituted bithiophene: The hidden role of noncovalent interaction and backbone conjugation | Lin T.-J.; Lin S.-T. | Physical Chemistry Chemical Physics | 22 | 21 | |
90 | 2015 | Screening of ionic liquids for CO2 capture using the COSMO-SAC model | Lee, B.-S.; Lin, S.-T.; SHIANG-TAI LIN | Chemical Engineering Science | | | |
91 | 2015 | Rapid Characterization and Validity Quantum Isotope Effect Between Light and Heavy Water through Two-Phase Thermodynamics | L. Yang; K.-Y. Yeh; S.-T. Lin | | | | |
92 | 2015 | Improved COSMO-SAC for Polar Nonhydrogen Bonding Species | W.-L. Chen; S.-T. Lin | | | | |
93 | 2015 | Nucleation of CH4+THF Mixed Guest Hydrate from Molecular Dynamic Simulations | J.-Y. Wu; S.-T. Lin | | | | |
94 | 2015 | First Principle Prediction of Equilibrium Constant of Esterification Reactions | C.-W. Chang; L. Yang; S.-T. Lin | | | | |
95 | 2015 | A Priori Prediction of Phase Behaviors of Ionic Liquids | B.-S. Lee; S.-T. Lin | | | | |
96 | 2015 | Ion-Pairing and Redissociation of Ionic Liquid | B.-S. Lee; S.-T. Lin | | | | |
97 | 2015 | Direct and Rapid Calculation of Entropy and Free Energy from Molecular Dynamics Simulations | S.-T. Lin | | | | |
98 | 2015 | A Priori Prediction of Dissociation Phenomena and Phase Behaviors of Ionic Liquids | Lee, B.-S.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
99 | 2015 | Can Molecular Dynamics Simulations Provide a Quantitative Description for the Rate of Methane Hydrate Dissociation? | H. Lo; S.-T. Lin | | | | |
100 | 2015 | Internal coordinate density of state from molecular dynamics simulation | Lai, P.-K.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Computational Chemistry | | | |
101 | 2015 | Rapid prediction of solvation free energy and vapor pressure of liquid and solid from molecular dynamics simulation | Yang, L.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Journal | | | |
102 | 2014 | Corrigendum to: Considering the dispersive interactions in the COSMO-SAC model for more accurate predictions of fluid phase behavior [Fluid Phase Equilib., 367, (2014), 109-116], 10.1016/j.fluid.2014.01.032 | Hsieh, C.-M.; Lin, S.-T. ; Jadran Vrabec | Fluid Phase Equilibria | | | |
103 | 2014 | Rapid determination of entropy for flexible molecules in condensed phase from the two-phase thermodynamic model | Lai, P.-K.; Lin, S.-T.; SHIANG-TAI LIN | RSC Advances | | | |
104 | 2014 | Diffusive and quantum effects of water properties in different states of matter | Yeh, K.-Y.; Huang, S.-N.; Chen, L.-J.; Lin, S.-T.; SHIANG-TAI LIN ; LI-JEN CHEN | Journal of Chemical Physics | | | |
105 | 2014 | Molecular Dynamics Simulation for Quantitative Description of Thermodynamic Properties of Methane Hydrates | H.-I. Chao; S. Luo; S.-T. Lin | | | | |
106 | 2014 | A Prior Prediction of the Phase Behavior of Acetic Acid and Its Mixture by Explicit Consideration of Hydrogen Bonded Dimers | W.-L. Chen; S.-T. Lin | | | | |
107 | 2014 | A Predictive Model to the Drug Solubility in Supercritical Carbon Dioxide | L.-H. Wang; S.-T. Lin | | | | |
108 | 2014 | First Principle Prediction of Equilibrium Constant of Esterification Reactions | P.-C. Yu; S.-T. Lin | | | | |
109 | 2014 | A predictive method for the solubility of drug in supercritical carbon dioxide | Wang, L.-H.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Supercritical Fluids | | | |
110 | 2014 | The Force Field Investigation for Accurate Thermodynamic Properties of Ch4-Thf Hydrates | J.-Y. Wu; S.-T. Lin | | | | |
111 | 2014 | Recent Advances in 2pt Theory for Fast Calculation of Material Entropy and Free Energy | S.-T. Lin | | | | |
112 | 2014 | Calculation of Thermodynamic Properties of Structure I Methane Hydrate from Molecular Dynamics Simulations | K.-Y. Yeh; S.-T. Lin ; L.-J. Chen | | | | |
113 | 2014 | Molecular Dynamics Simulation for Quantitative Description of Thermodynamic Properties of Methane Hydrates | H.-I. Chao; S. Luo; S.-T. Lin | | | | |
114 | 2014 | A New Force Field for Accurate Thermodynamic Properties of Ch4-Thf Hydrates | J.-Y. Wu; S.-T. Lin | | | | |
115 | 2014 | A priori prediction of the vapor-liquid equilibria of mixtures of acetic acid and water or alcohols by explicit consideration of hydrogen-bonded dimers | Chen, W.-L.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
116 | 2014 | A priori prediction of the octanol-water partition coefficient (Kow) of ionic liquids | Lee, B.-S.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
117 | 2014 | Considering the dispersive interactions in the COSMO-SAC model for more accurate predictions of fluid phase behavior | Hsieh, C.-M.; Lin, S.-T.; Vrabec, J.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
118 | 2013 | Band gap engineering via controlling donor-acceptor compositions in conjugated copolymers | Hung, Ying Chieh; CHI-YANG CHAO ; CHI-AN DAI ; WEI-FANG SU ; SHIANG-TAI LIN | Journal of Physical Chemistry B | 10 | 9 | |
119 | 2013 | Prediction of phase equilibrium for gas hydrate in the presence of organic inhibitors and electrolytes by using an explicit pressure-dependent Langmuir adsorption constant in the van der Waals-Platteeuw model | Chin, H.-Y.; Hsieh, M.-K.; Chen, P.-C.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Chemical Thermodynamics | | | |
120 | 2013 | Measurements for the dissociation conditions of methane hydrate in the presence of 2,5-dihydrofuran and 3,4-dihydro-2H-pyran | Cheng, C.-T.; Chen, L.-J. ; Lin, S.-T. ; Tang, M.; Chen, P.-C.; Chen Y.-P. | Fluid Phase Equilibria | | | |
121 | 2013 | Prediction of phase behaviors of acetic acid containing fluids | Chen, W.-L.; Hsu, C.-C.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
122 | 2013 | Prediction of phase behaviors of ionic liquids over a wide range of conditions | Lee, B.-S.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
123 | 2013 | Prediction of phase behaviors of polymer-solvent mixtures from the COSMO-SAC activity coefficient model | Kuo, Y.-C.; Hsu, C.-C.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
124 | 2013 | Fluid-phase coexistence for the oxidation of CO2 expanded cyclohexane: Experiment, molecular simulation, and COSMO-SAC | Merker, T.; Hsieh, C.-M.; Lin, S.-T.; Hasse, H.; Vrabec, J.; SHIANG-TAI LIN | AIChE Journal | | | |
125 | 2013 | Measurements of the Dissociation Conditions of Gas Hydrates in the Presence of Hydrocarbon Additives | Y.-P. Chen; L.-J. Chen; S.-T. Lin ; M. Tang | | | | |
126 | 2013 | Prediction of phase equilibrium of methane hydrates in the presence of ionic liquids | Chin, H.-Y.; Lee, B.-S.; Chen, Y.-P.; Chen, P.-C.; Lin, S.-T.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Industrial and Engineering Chemistry Research | 26 | 24 | |
127 | 2013 | Primary Nucleation of Methane Hydrates via Molecular Dynamics Simulation | H.-H. Ma; S.-T. Lin | | | | |
128 | 2013 | Fluid phase coexistence for the oxidation of cyclohexane in CO<inf>2</inf>expanded liquids: COSMO-SAC vs. molecular simulation | Hsieh, C.-M.; Merker, T.; Lin, S.-T.; Hasse, H.; SHIANG-TAI LIN | Chemie-Ingenieur-Technik | 0 | 0 | |
129 | 2013 | Prediction of Phase Behavior of Strongly Associating Fluids By Explicit Consideration of Transitions in Local Fluid Structures | W.-L. Chen; C.-C. Hsu; S.-T. Lin | | | | |
130 | 2013 | Simultaneous Modeling of the Vapor-Liquid and Liquid-Liquid Equilibria of Fluids Containing Acetic Acid | W.-L. Chen; S.-T. Lin | | | | |
131 | 2013 | Theoretical Study on Resistive Memory Devices based on Polyimides | L.-C. Chan; S.-T. Lin | | | | |
132 | 2013 | Prediction of the drug solubility in Supercritical Carbon Dioxide | L.-H. Wang; S.-T. Lin | | | | |
133 | 2013 | Theoretical Study on the Surface Modified TiO2:P3HT Hybrid Solar Cells | Y.-H. Li; S.-T. Lin | | | | |
134 | 2013 | A Predictive Model to the Drug Solubility in Supercritical Carbon Dioxide | L.-H. Wang; S.-T. Lin | | | | |
135 | 2013 | Growth of Tetrahydrofuran (THF) Clathrate Hydrates: A Molecular Dynamics Study | J.-Y. Wu; S.-T. Lin | | | | |
136 | 2013 | Effect of Chain Length of Ionic Liquid On the Formation of Methane Hydrate | C.-K. Chu; H.-Y. Chin; P.-C. Chen; Y.-P. Chen; S.-T. Lin ; L.-J. Chen | | | | |
137 | 2013 | Understanding the Role of Dispersive Interactions in the COSMO-SAC Model | C.-M. Hsieh; S.-T. Lin ; J. Vrabec | | | | |
138 | 2013 | Band Gap Engineering on Conjugated Polymers for High Efficiency Organic Solar Cells | Y.-C. Hung; S.-T. Lin | | | | |
139 | 2013 | Primary Nucleation of Methane Hydrates via Molecular Dynamics Simulation | H.-H. Ma; S.-T. Lin | | | | |
140 | 2013 | Growth of Tetrahydrofuran (THF) Clathrate Hydrates: A Molecular Dynamics Study | J.-Y. Wu; S.-T. Lin | | | | |
141 | 2013 | Growth of Tetrahydrofuran (THF) Clathrate Hydrates: A Molecular Dynamics Study | J.-Y. Wu; S.-T. Lin | | | | |
142 | 2013 | Prediction of Phase Behaviors of Ionic Liquids Over a Wide Range of Conditions | B.-S. Lee; S.-T. Lin | | | | |
143 | 2013 | Prediction of Drug Solubility in Supercritical Carbon Dioxide | L.-H. Wang; S.-T. Lin | | | | |
144 | 2013 | Application of COSMO-SAC and Molecular Simulation to An Industrially Important Pentenary System | C.-M. Hsieh; T. Merker; S.-T. Lin ; H. Hasse,; J. Vrabec | | | | |
145 | 2012 | Explicit pressure dependence of the Langmuir adsorption constant in the van der Waals-Platteeuw model for the equilibrium conditions of clathrate hydrates | Hsieh, M.-K.; Ting, W.-Y.; YAN-PING CHEN ; Chen, P.-C.; SHIANG-TAI LIN ; LI-JEN CHEN | Fluid Phase Equilibria | | | |
146 | 2012 | Predictive method for the change in equilibrium conditions of gas hydrates with addition of inhibitors and electrolytes | Hsieh, M.-K.; Yeh, Y.-T.; Chen, Y.-P.; Chen, P.-C.; Lin, S.-T.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Industrial and Engineering Chemistry Research | 34 | 30 | |
147 | 2012 | Theoretical investigation of the metal-doped SrTiO 3 photocatalysts for water splitting | Chen, H.-C.; Huang, C.-W.; Wu, J.C.S.; Lin, S.-T.; SHIANG-TAI LIN ; JEFFREY CHI-SHENG WU | Journal of Physical Chemistry C | | | |
148 | 2012 | Rapid determination of entropy and free energy of mixtures from molecular dynamics simulations with the two-phase thermodynamic model | Lai, P.-K.; Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | Physical Chemistry Chemical Physics | | | |
149 | 2012 | Band structure engineering for low band gap polymers containing thienopyrazine | Chao, C.-Y.; Chao, C.-H.; Chen, L.-P.; Hung, Y.-C.; Lin, S.-T.; Su, W.-F.; Lin, C.-F.; SHIANG-TAI LIN ; CHI-YANG CHAO ; CHING-FUH LIN ; WEI-FANG SU | Journal of Materials Chemistry | | | |
150 | 2012 | Stability of positively charged solutes in water: A transition from hydrophobic to hydrophilic | Pascal, T.A.; Lin, S.-T.; Goddard, W.; Jung, Y.; SHIANG-TAI LIN | Journal of Physical Chemistry Letters | | | |
151 | 2012 | Molecular dynamics study on the growth of structure i methane hydrate in aqueous solution of sodium chloride | Tung, Y.-T.; Chen, L.-J.; Chen, Y.-P.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Physical Chemistry B | 67 | 66 | |
152 | 2012 | Prediction of phase behaviors of strong association systems by PR+cosmosac equation of state | Hsu, C.-C.; Chen, W.-L.; Lin, S.-T.; SHIANG-TAI LIN | 2012 AIChE Annual Meeting | | | |
153 | 2012 | The role of long-range interactions in the phase behavior of ionic liquids | Lee, B.-S.; Lin, S.-T.; SHIANG-TAI LIN | Physical Chemistry Chemical Physics | | | |
154 | 2012 | First-principles prediction of phase equilibria using the PR + COSMOSAC equation of state | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | Asia-Pacific Journal of Chemical Engineering | | | |
155 | 2012 | Effect of mixing rule boundary conditions on high pressure (liquid + liquid) equilibrium prediction | Hsieh, M.-K.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Chemical Thermodynamics | | | |
156 | 2011 | Band structure engineering for low band gap polymers based on 3-hexylthiophene and thienopyrazine | CHI-YANG CHAO ; Chao, Chung Hsiang; Chen, Lung Pin; Hung, Ying Chieh; SHIANG-TAI LIN ; WEI-FANG SU | ACS National Meeting Book of Abstracts | 0 | 0 | |
157 | 2011 | In situ methane recovery and carbon dioxide sequestration in methane hydrates: A molecular dynamics simulation study | Tung, Y.-T.; Chen, L.-J.; Chen, Y.-P.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Physical Chemistry B | 78 | 74 | |
158 | 2011 | Measurements for the dissociation conditions of methane hydrate in the presence of 1,3,5-trioxane and oxolan-2-ylmethanol | Ko, W.-Y.; Chen, L.-J.; Lin, S.-T.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Chemical and Engineering Data | 14 | 14 | |
159 | 2011 | A special tribute to Stan Sandler: The reach and impact of a life-long dedication to the chemical engineering profession | Sum, A.K.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | 0 | 0 | |
160 | 2011 | Thermodynamics of water entry in hydrophobic channels of carbon nanotubes | Kumar, H.; Mukherjee, B.; Lin, S.-T.; Dasgupta, C.; Sood, A.K.; Maiti, P.K.; SHIANG-TAI LIN | Journal of Chemical Physics | | | |
161 | 2011 | A predictive model for the solubility and octanol-water partition coefficient of pharmaceuticals | Hsieh, C.-M.; Wang, S.; Lin, S.-T.; S; ler, S.I.; SHIANG-TAI LIN | Journal of Chemical and Engineering Data | | | |
162 | 2011 | Thermodynamics of liquids: Standard molar entropies and heat capacities of common solvents from 2PT molecular dynamics | Pascal, T.A.; Lin, S.-T.; Goddard III, W.A.; SHIANG-TAI LIN | Physical Chemistry Chemical Physics | | | |
163 | 2011 | A predictive model for the excess gibbs free energy of fully dissociated electrolyte solutions | Hsieh, M.-T.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Journal | | | |
164 | 2011 | First-principles prediction of vapor-liquid-liquid equilibrium from the PR+COSMOSAC equation of state | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
165 | 2011 | Prediction of drug solubility in mixed solvent systems using the COSMO-SAC activity coefficient model | Shu, C.-C.; Lin, S.-T.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
166 | 2011 | Employing an amphiphilic interfacial modifier to enhance the performance of a poly(3-hexyl thiophene)/TiO 2 hybrid solar cell | Huang Y.-C.; Hsu J.-H.; Liao Y.-C.; Yen W.-C.; Li S.-S.; SHIANG-TAI LIN ; CHUN-WEI CHEN ; WEI-FANG SU | Journal of Materials Chemistry | 55 | 53 | |
167 | 2011 | Thermodynamic Properties and Fluid Phase Equilibria without Experimental Measurements | LIN SHIANG-TAI ; C.M. Hsieh | Application of Thermodynamics to Biological and Materials Science | | | |
168 | 2011 | Marching into molecular design | SHIANG-TAI LIN | Asia-Pacific Journal of Chemical Engineering | 3 | 3 | |
169 | 2011 | Growth of structure i carbon dioxide hydrate from molecular dynamics simulations | Tung, Y.-T.; Chen, L.-J.; Chen, Y.-P.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Physical Chemistry C | 74 | 69 | |
170 | 2011 | Band structure engineering for low band gap polymers based on 3-hexylthiophene and thienopyrazine | Chao, C.-Y.; Chao, C.-H.; Chen, L.-P.; Hung, Y.-C.; Lin, S.-T.; Su, W.-F.; SHIANG-TAI LIN | ACS National Meeting Book of Abstracts | | | |
171 | 2011 | Absolute entropy and energy of carbon dioxide using the two-phase thermodynamic model | Huang, S.-N.; Pascal, T.A.; Goddard, W.A.; Maiti, P.K.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Chemical Theory and Computation | | | |
172 | 2011 | Prediction of miscibility gaps in water/ether mixtures using COSMO-SAC model | Lin, S.-T.; Wang, L.-H.; Chen, W.-L.; Lai, P.-K.; Hsieh, C.-M.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
173 | 2011 | New donor-acceptor oligoimides for high-performance nonvolatile memory devices | Lee, W.-Y.; Kurosawa, T.; Lin, S.-T.; Higashihara, T.; Ueda, M.; Chen, W.-C.; SHIANG-TAI LIN ; WEN-CHANG CHEN | Chemistry of Materials | | 93 | |
174 | 2011 | A priori predictions of critical loci from the combined use of PRSV equation of state and the COSMO-SAC model through the MHV1 mixing rule | Tai, Y.-S.; Hsieh, M.-T.; Lee, M.-T.; Wong, D.S.H.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
175 | 2010 | Measurements for the dissociation conditions of methane hydrate in the presence of 2-Methyl-2-propanol | Kuo, P.-C.; Chen, L.-J.; Lin, S.-T.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Chemical and Engineering Data | 22 | 21 | |
176 | 2010 | Prediction of liquid-liquid equilibrium from the Peng-Robinson+COSMOSAC equation of state | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | Chemical Engineering Science | | | |
177 | 2010 | Two-phase thermodynamic model for efficient and accurate absolute entropy of water from molecular dynamics simulations | Lin, S.-T.; Maiti, P.K.; Goddard III, W.A.; SHIANG-TAI LIN | Journal of Physical Chemistry B | | | |
178 | 2010 | The growth of structure i methane hydrate from molecular dynamics simulations | Tung, Y.-T.; Chen, L.-J.; Chen, Y.-P.; SHIANG-TAI LIN ; LI-JEN CHEN ; Chen Y.-P. | Journal of Physical Chemistry B | 115 | 107 | |
179 | 2010 | Entropy and dynamics of water in hydration layers of a bilayer | Debnath, A.; Mukherjee, B.; Ayappa, K.G.; Maiti, P.K.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Chemical Physics | | | |
180 | 2010 | Improvements of COSMO-SAC for vapor-liquid and liquid-liquid equilibrium predictions | Hsieh, C.-M.; S; ler, S.I.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
181 | 2009 | Theoretical study on the correlation between band gap, bandwidth, and oscillator strength in fluorene-based donor-acceptor conjugated copolymers | Hung, Ying Chieh; Jiang, Jyh Chiang; CHI-YANG CHAO ; WEI-FANG SU ; SHIANG-TAI LIN | Journal of Physical Chemistry B | 75 | 67 | |
182 | 2009 | First-Principles Predictions of Vapor-Liquid Equilibria for Pure and Mixture Fluids from the Combined Use of Cubic Equations of State and Solvation Calculations | Hsieh, CM; SHIANG-TAI LIN | INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH | 46 | 46 | |
183 | 2009 | Towards the development of theoretically correct liquid activity coefficient models | SHIANG-TAI LIN ; Hsieh, MK; Hsieh, CM; Hsu, CC | Journal of Chemical Thermodynamics | 17 | 18 | |
184 | 2009 | Use of GAMESS/COSMO program in support of COSMO-SAC model applications in phase equilibrium prediction calculations | Wang, S; Lin, ST; Watanasiri, S; Chen, CC; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
185 | 2009 | Synthesis and characterization of low bandgap copolymers based on lndenofluorene and thiophene derivative | Yen, W.-C.; Pal, B.; Yang, J.-S.; Hung, Y.-C.; Lin, S.-T.; Chao, C.-Y.; Su, W.-F.; SHIANG-TAI LIN ; CHI-YANG CHAO ; WEI-FANG SU ; JYE-SHANE YANG | Journal of Polymer Science, Part A: Polymer Chemistry | | | |
186 | 2009 | Prediction of 1-octanol-water partition coefficient and infinite dilution activity coefficient in water from the PR + COSMOSAC model | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
187 | 2009 | Reply to "Comment on "Towards the development of theoretically correct liquid activity coefficient models"" | Lin, S.-T.; Hsieh, M.-K.; Hsieh, C.-M.; Hsu, C.-C.; Huang, S.-N.; SHIANG-TAI LIN | Journal of Chemical Thermodynamics | | | |
188 | 2009 | Early structural development in melt-quenched polymer PTT from atomistic molecular dynamic simulations | Hsieh, M.-K.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Physics Condensed Matter | | | |
189 | 2008 | Substituent Effect on the Optoelectronic Properties of Alternating Fluorene-Cyclopentadithiophene Copolymers | Pal, Bikash; Yen, Wei-Che; Yang, Jye-Shane ; Chao, Chi-Yang ; Hung, Ying-Chieh; Lin, Shiang-Tai ; Chuang, Chia-Hao; Chen, Chun-Wei ; Su, Wei-Fang | Macromolecules | 71 | 72 | |
190 | 2008 | Stress-induced crystallization of poly(Trimethylene Terephthalate) fibers by molecular dynamic simulations | Hsieh, M.-K.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting | | | |
191 | 2008 | Stress-induced crystallization of poly(Trimethylene Terephthalate) fibers by molecular dynamic simulations | Hsieh, M.-K.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting | | | |
192 | 2008 | Determination of cubic equation of state parameters for pure fluids from first principle solvation calculations | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Journal | | | |
193 | 2008 | Determination of cubic equation of state parameters for pure and mixture fluids from first principle solvation calculations | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting, Conference Proceedings | | | |
194 | 2008 | Determination of cubic equation of state parameters for pure and mixture fluids from first principle solvation calculations | Hsieh, C.-M.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting, Conference Proceedings | | | |
195 | 2008 | Reply to "comments on 'refinement of COSMO - SAC and the applications" | Sandler, S.I.; Wang, S.; Lin, S.T.; Goddard III, W.A.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | 2 | 2 | |
196 | 2008 | Improper matching of solvation energy components in Gex-based mixing rules | Lin, S.-T.; Hsieh, M.-T.; Lin, Shiang-Tai; Hsieh, Meng-Ting; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
197 | 2007 | 以分子電腦模擬探討PTT(聚對苯二甲酸丙二酯)纖維之結構與性質之關係(2/3) | 林祥泰 | | | | |
198 | 2007 | 以分子電腦模擬探討PTT(聚對苯二甲酸丙二酯)纖維之結構與性質之關係(3/3) | 林祥泰 | | | | |
199 | 2007 | Solvation and chemical engineering thermodynamics | Lin, S.-T.; Hsieh, C.-M.; Lee, M.-T.; Lin, Shiang-Tai; Hsieh, Chieh-Ming; Lee, Ming-Tsung; SHIANG-TAI LIN ; MING-TSUNG LEE | Journal of the Chinese Institute of Chemical Engineers | | | |
200 | 2007 | Molecular dynamic simulations of polymer crystallization at the early stage | Hsieh, M.-K.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting, Conference Proceedings | | | |
201 | 2007 | Prediction of mixture vapor–liquid equilibrium from the combined use of Peng–Robinson equation of state and COSMO-SAC activity coefficient model through the Wong–Sandler mixing rule | Lee, Ming-Tsung ; Lin, Shiang-Tai | Fluid Phase Equilibria | | | |
202 | 2007 | Molecular dynamic simulations of polymer crystallization at the early stage | Hsieh, M.-K.; Lin, S.-T.; SHIANG-TAI LIN | AIChE Annual Meeting, Conference Proceedings | | | |
203 | 2007 | Prediction of mixture vapor-liquid equilibrium from the combined use of Peng-Robinson equation of state and COSMO-SAC activity coefficient model through the Wong-Sandler mixing rule | Lee, M.-T.; Lin, S.-T.; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
204 | 2006 | Dynamic modeling and control structure design of an experimental fuel processor | Lin, Shi-Tin; Chen, Yih-Hang; Yu, Cheng-Ching; Liu, Yen-Chun; SHIANG-TAI LIN | International Journal of Hydrogen Energy | | 27 | |
205 | 2006 | Entropy of Water in the Hydration Layer of Major and Minor Grooves of DNA | Jana, Biman; Pal, Subrata; Maiti, Prabal K.; Lin, Shiang-Tai ; Hynes, James T.; Bagchi, Biman | The Journal of Physical Chemistry B | 80 | 80 | |
206 | 2006 | Reply to the comment on "application of the COSMO-SAC-BP solvation model to predictions of normal boiling temperatures for environmentally significant substances" | Wang, S.; Lin, S.-T.; Chang, J.; Goddard III, W.A.; Sandler, S.I.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | 2 | 2 | |
207 | 2006 | Mechanical properties of nanocrystalline diamond films | Shen, Z. H.; Hess, P.; Huang, J. P.; Lin, Y. C.; Chen, K. H.; Chen, L. C.; SHIANG-TAI LIN ; Chen, L.C. | Journal of Applied Physics | 30 | 25 | |
208 | 2006 | Application of the COSMO-SAC-BP Solvation Model to Predictions of Normal Boiling Temperatures for Environmentally Significant Substances | Wang, Shu; Lin, Shiang-Tai ; Chang, Jaeeon; Goddard III, William A.; Sandler, Stanley I. | Industrial & Engineering Chemistry Research | 33 | 31 | |
209 | 2006 | Efficient and accurate solvation energy calculation from polarizable continuum models | Lin, S.-T.; Hsieh, C.-M.; SHIANG-TAI LIN | Journal of Chemical Physics | | | |
210 | 2006 | Thermodynamic equations of state from molecular solvation | Lin, Shiang-Tai; SHIANG-TAI LIN | Fluid Phase Equilibria | | | |
211 | 2005 | 淺談電腦分子模擬在化學工程之應用 | 林祥泰 | 化工技術 | | | |
212 | 2005 | Effect of solvent and pH on the structure of PAMAM dendrimers | Maiti, P.K.; Cagin, T.; Lin, S.T.; SHIANG-TAI LIN | Macromolecules | 393 | 372 | |
213 | 2005 | Dynamics and thermodynamics of water in PAMAM dendrimers at subnanosecond time scales | Lin, S.T.; Maiti, P.K.; SHIANG-TAI LIN | Journal of Physical Chemistry B | 136 | 130 | |
214 | 2005 | Mobile construction supply chain management using PDA and Bar Codes | Tserng, H.P.; Dzeng, R.-J.; Lin, Y.-C.; HUI-PING TSERNG ; SHIANG-TAI LIN | Computer-Aided Civil and Infrastructure Engineering | 52 | 39 | |
215 | 2005 | Reaction of Mo(CO)(4)(NCCH3)(2) and 7-aza-2-tosylnorbornadiene | Ding, M. F.; Lin, S. T.; Chow, T. J.; SHIANG-TAI LIN | Inorganica Chimica Acta | | | |
216 | 2005 | 利用多重尺度電腦模擬預測複雜系統之熱物性質及相平衡 | 林祥泰 ; Lin, Shiang-Tai | | | | |
217 | 2005 | Nanophase segregation and water dynamics in the dendrion diblock copolymer formed from the Fréchet polyaryl ethereal dendrimer and linear PTFE | Jang, S.S.; Lin, S.-T.; ?a?in, T.; Molinero, V.; Goddard III, W.A.; SHIANG-TAI LIN | Journal of Physical Chemistry B | | | |
218 | 2005 | Modelling an experimental methane fuel processor | Lin, Shi-Tin; Chen, Yih-Hang; Yu, Cheng-Ching; Liu, Yen-Chun; SHIANG-TAI LIN | Journal of | 27 | 26 | |
219 | 2004 | Factors affecting the significance of gravity on the infiltration of a liquid into a porous solid | Chan, T. Y.; Hsu, C. S.; Lin, S. T.; SHIANG-TAI LIN | Journal of Porous Materials | | | |
220 | 2004 | Molecular dynamics study of a surfactant-mediated decane-water interface: Effect of molecular architecture of alkyl benzene sulfonate | Jang, S.S.; Shiang-Tai, L.; Maiti, P.K.; Blanco, M.; Goddard III, W.A.; Shuler, P.; Tang, Y.; SHIANG-TAI LIN | Journal of Physical Chemistry B | | | |
221 | 2004 | Erratum: A Priori Phase Equilibrium Prediction from a Segment Contribution Solvation Model (Industrial and Engineering Chemistry Research 41, 5 (903)) | Lin, S.-T.; S; ler, S.I.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
222 | 2004 | Erratum: A Priori Phase Equilibrium Prediction from a Segment Contribution Solvation Model (Industrial and Engineering Chemistry Research 41, 5 (903)) | Lin, S.-T.; Sandler, S.I.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
223 | 2004 | Thermodynamic stability of zimmerman self-assembled dendritic supramolecules from atomistic molecular dynamics simulations | Lin, S.-T.; Jang, S.S.; ?a?m, T.; Goddard III, W.A.; SHIANG-TAI LIN | Journal of Physical Chemistry B | | | |
404 | 2004 | Efficiency of Various Lattices from Hard Ball to Soft Ball: Theoretical Study of Thermodynamic Properties of Dendrimer Liquid Crystal from Atomistic Simulation | Li, Y.; Lin, S.-T.; Goddard III, W.A.; SHIANG-TAI LIN | Journal of the American Chemical Society | | | |
405 | 2004 | Prediction of vapor pressures and enthalpies of vaporization using a COSMO solvation model | Lin, S.-T.; Chang, J.; Wang, S.; Goddard III, W.A.; S; ler, S.I.; SHIANG-TAI LIN | Journal of Physical Chemistry A | | | |
406 | 2004 | X-Ray absorption studies of boron-carbon-nitrogen (BxCyNz) ternary alloys | Ray, S. C.; Tsai, H. M.; Chiou, J. W.; Jan, J. C.; Kumar, K.; Pong, W. F.; Chien, F. Z.; Tsai, M. H.; Chattopadhyay, S.; Chen, L. C.; Chien, S. C.; Lee, M. T.; SHIANG-TAI LIN ; LI-CHYONG CHEN | Diamond and Related Materials | 19 | 20 | |
407 | 2004 | Electronic and bonding structures of B-C-N thin films investigated by x-ray absorption and photoemission spectroscopy | Ray, S. C.; Tsai, H. M.; Bao, C. W.; Chiou, J. W.; Jan, J. C.; Kumar, K. P. K.; Pong, W. F.; Tsai, M. H.; Chattopadhyay, S.; Chen, L. C.; Chien, S. C.; Lee, M. T.; Lin, S. T.; Chen, K. H.; SHIANG-TAI LIN | Journal of Applied Physics | | 20 | |
408 | 2003 | Mechanical properties of amorphous boron carbon nitride films produced by dual gun sputtering | Chien, S. C.; Chattopadhyay, S.; Chen, L. C.; Lin, S. T.; Chen, K. H.; SHIANG-TAI LIN | Diamond and Related Materials | | | |
409 | 2003 | The two-phase model for calculating thermodynamic properties of liquids from molecular dynamics: Validation for the phase diagram of Lennard-Jones fluids | Lin, S.-T.; Blanco, M.; Goddard III, W.A.; SHIANG-TAI LIN | Journal of Chemical Physics | | | |
410 | 2002 | The K value distribution of liquid phase sintered microstructures | Liu, P. L.; SHIANG-TAI LIN ; PEI-LING LIU | Materials Transactions | 6 | 6 | |
411 | 2002 | Bonding characterization, density measurement, and thermal diffusivity studies of amorphous silicon carbon nitride and boron carbon nitride thin films | Chattopadhyay, S.; Chen, L. C.; Chien, S. C.; Lin, S. T.; Chen, K. H.; SHIANG-TAI LIN | Journal of Applied Physics | | 17 | |
412 | 2002 | Henry's law constant of organic compounds in water from a group contribution model with multipole corrections | Lin, S.-T.; S; ler, S.I.; SHIANG-TAI LIN | Chemical Engineering Science | | | |
413 | 2002 | Comments on "A priori phase equilibrium prediction from a segment contribution solvation model" (Multiple letters) | Klamt, A.; Lin, S.-T.; S; ler, S.I.; SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | | | |
414 | 2002 | A priori phase equilibrium prediction from a segment contribution solvation model | SHIANG-TAI LIN | Industrial and Engineering Chemistry Research | 685 | 644 | |
415 | 2002 | The use of quantum chemistry to predict phase behavior for environmental and process engineering | Sandler, S.I.; Lin, S.-T.; Sum, A.K.; SHIANG-TAI LIN | Fluid Phase Equilibria | 17 | 16 | |
416 | 2002 | Phase and thickness dependence of thermal diffusivity in a-SiCxNy and a-BCxNy | Chattopadhyay, S.; Chen, L. C.; Chien, S. C.; Lin, S. T.; Wu, C. T.; Chen, K. H.; SHIANG-TAI LIN | Thin Solid Films | | 3 | |
417 | 2002 | Reply to comments on "a priori phase equilibrium prediction from a segment contribution solvation model" | Lin, S. T.; Sandler, S. I.; SHIANG-TAI LIN | Industrial & Engineering Chemistry Research | | 15 | |
418 | 2001 | Bonding characterization and nano-indentation study of the amorphous SiCxNy films with and without hydrogen incorporation | Lo, H. C.; Wu, J. J.; Wen, C. Y.; Wong, T. S.; Lin, S. T.; Chen, K. H.; SHIANG-TAI LIN ; LI-CHYONG CHEN | Diamond and Related Materials | 15 | 15 | |
419 | 2001 | Some chemical engineering applications of quantum chemical calculations | S; ler, S.I.; Sum, A.K.; Lin, S.-T.; SHIANG-TAI LIN | Advances in Chemical Engineering | | | |
420 | 2001 | Growth of highly transparent nanocrystalline diamond films and a spectroscopic study of the growth | Chen, L. C.; Kichambare, P. D.; Chen, K. H.; Wu, J. J.; Yang, J. R.; SHIANG-TAI LIN ; JER-REN YANG | Journal of Applied Physics | 45 | 40 | |
421 | 2000 | Multipole corrections to account for structure and proximity effects in group contribution methods: Octanol-water partition coefficients | Lin, S.-T.; S; ler, S.I.; SHIANG-TAI LIN | Journal of Physical Chemistry A | | | |
422 | 2000 | Effect of carbon sources on silicon carbon nitride films growth in an electron cyclotron resonance plasma chemical vapor deposition reactor | Wu, J. J.; Chen, K. H.; Wen, C. Y.; Chen, L. C.; Guo, X. J.; Lo, H. J.; Lin, S. T.; Yu, Y. C.; Wang, C. W.; SHIANG-TAI LIN ; CHENG-YEN WEN ; LI-CHYONG CHEN | Diamond and Related Materials | 14 | 15 | |
423 | 2000 | Blind-hole residual stress determination using optical interferometry | Lin, S. T.; SHIANG-TAI LIN | Experimental Mechanics | | 8 | |