期刊論文

學年期 標題 Sdgs 更新時間
097 / 2 Development of Fluorescent 2-Pyrone derivatives using Ketene Dithioacetals for organic EL devices #04.優質教育 #07.可負擔的潔淨能源 #09.產業創新與基礎設施 #12.負責任的消費與生產 2018-04-09
097 / 2 One-pot synthesis of 6-substituted amino-2,4-diaminopyrimidine derivatives using ketene dithioacetals with amines and guandine carbonate 2017-03-08
097 / 2 Synthesis of Quinolizino[3,2,-a]Quinolizine derivatives and their fluorescence 2010-08-10
096 / 1 Deposition rate effect of Alq3 thin film growth: A kinetic Monte Carlo study 2017-01-04
097 / 1 Theoretical study of optical and electronic properties of p-terphenyls containing cyano substituents as promising light-emitting materials 2013-11-15
096 / 2 Structural and Optical Properties of Passivated Silicon Nanoclusters with Different Shapes: A Theoretical Investigation 2017-03-29
082 / 1 Calculations on Heterofullerenes: C24N4, C36N4 and C52N4 2014-06-26
085 / 2 Comparative theoretical study of carbon nanotubes and boron-nitride nanotubes 2016-12-29
095 / 1 DFT-PCM studies of the solvent effects on the absorption properties of DCM 2017-01-05
095 / 2 Electronic structure and molecular orbital study of hole-transport material triphenylamine derivatives 2017-01-10
085 / 2 Electrochemical reduction of C60 and C70 films in N(Me)4(ClO4)/MeCN 2017-01-10
083 / 2 Electrochemiacl doping of tetraethylammonium on C60 film 2017-01-10
083 / 2 Icosahedral and tetrahedral giant and hyperfullerenes 2014-06-25
081 / 2 Geometry and orbital symmetry relationships of giant and hyperfullerenes: Csub 240, Csub 540, 2010-06-16
090 / 1 High field effect mobility oligofluorene derivatives with high environmental stability 2017-01-13
086 / 1 Molecular dynamics simulation of polymers adsorbed on alumina surface 2010-06-16
082 / 2 球烯、異球烯與巨球烯的結構、理論與計算 2010-06-16
084 / 1 模擬聚合物分子在氧化鋁表面的吸附現象(1) 2010-06-16
085 / 1 模擬聚合物分子在氧化鋁表面的吸附現象(Ⅱ) 2010-06-16
086 / 2 模擬在矽氧表面上聚合物分子於四氯化碳溶劑之吸附現象 2010-06-16
080 / 2 Atomic overlaps, molecular orbitals and vibrational transformation in the polyhedral clusters M12(Oh) and M12(Ih) 2014-01-07
093 / 2 Theoretical investigation of carbazole derivatives as hole-transporting materials in OLEDs 2017-05-03
093 / 2 Theoretical investigation of electro-luminescent properties in red emission DCM, DCJ, RED and DAD derivatives 2017-05-03
093 / 2 Theoretical investigation of pyrazolo[3,4-b]quinoline derivatives as emitting materials 2017-05-03
093 / 2 Theoretical investigation of stokes shift of 3,4-diaryl-substituted maleimide fluorophores 2017-05-03
091 / 2 Theoretical investigation the electroluminescence characteristic of pyrene and its derivatives 2017-05-03
096 / 1 Theoretical investigations of the molecular conformation and reorganization energies in the organic diamines as hole-transporting materials 2014-01-14
095 / 1 Theoretical investigations of triphenylamine derivatives as hole transporting materials in OLEDs: Correction of the Hammet parameter of the substituent to ionization potential and reorganization energy level 2017-05-03
088 / 2 Theoretical studies of azulene and its derivatives 2014-01-06
090 / 1 Thiophene-Phenylene and Thiophene-Thiazole Oligomeric Semiconductors with High Field-Effect Transistor On/Off Ratios #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 2017-05-04
086 / 1 Theoretical studies of C60/C70 fullerence derivatives : C60O and C70O 2017-05-03
090 / 2 Theoretical studies of C70(OH)n(n = 14, 16, 18 and 20)fullerenols 2017-05-03
084 / 1 Theoretical study of C60, C76, and C84 fullerenes and their isomeric rearrangement mechanisms by semiempirical methods #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 2017-05-03
085 / 1 Valence points and symmetry views of the structures of carbon clusters, fullerenes and metallofullerenes #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 2017-05-08
087 / 2 分子動力學模擬結合相液態層析法的分離機制 2017-05-16
087 / 2 Ab initio study of the addition of atomic carbon with water 2016-12-16
090 / 2 Ab initio study of the ammoniated ammonium ions NH4+(NH3)0–6 2016-12-16
090 / 1 芘及其衍生物電子性質之理論探討 2012-04-23
079 / 2 Symmetry analysis of the electronic structure of polyhedron clusters M12 (O) and M60(Ih) 2014-01-07
081 / 2 Symmetry and geometry structure of polyhedral atomic and molecular clusters 2017-03-29
085 / 2 Structures and stabilities of C60(OH)6 and C60(OH)12 fullerenols 2017-03-29
087 / 2 Spherical shape of the goldberg type giant fullerenes 2017-03-28
088 / 1 Semiempirical molecular dynamics studies of C60/C70 fullerence oxides : C60O, C60O2 and C70O 2017-03-23
089 / 2 More spherical large fullerenes and multi-layer fullerene cages 2017-03-01
091 / 2 Oligofluorene-thiophene derivatives as high performance semiconductors for organic thin film transistors 2017-01-13
099 / 2 Investigation of Photophysical Properties of mer-Tris(8-hydroxyquinolinato) Aluminum (III) and Its Derivatives: DFT and TD-DFT Calculations 2014-12-10
083 / 1 結構對稱分析對於球烯重排反應 2011-10-15
096 / 1 利用動力蒙地卡羅方法來探討半導體階梯表面上的成長過程 2011-10-15
082 / 1 巨球烯之幾何結構 2011-10-15
085 / 1 Valence points and symmetry views of the structures of carbon clusters, fullerenes and metallofullerenes 2017-05-08
097 / 2 Theoretical Investigation of Organic Amines as Hole Transporting Materials: Correlation to the Hammett Parameter of the Substituent, Ionization Potential, and Reorganization Energy Level 2014-01-20
092 / 1 Theortical investigation of electronluminescent material 1,4-distyrylbenzene derivatives 2011-10-15
090 / 1 Thiophere-phenylene and thiophene-thiazole oligomeric semiconductors with high field-effect transistor On/Off ratios #03.良好健康和福祉 #04.優質教育 #12.負責任的消費與生產 2017-05-04
096 / 1 Step-Flow Growth On Semiconductor-Like Stepped Surface: A Kinetic Monte Carlo Study 2013-12-09
090 / 2 Molecular dynamics simulation of separation mechanisms in bonded phase liquid chromatography 2017-03-01
097 / 2 Infinite single-walled boron-nitride nanotubes studies by LGTO-PBC-DFT method 2017-01-13
096 / 2 Effect of substituent and solvent on the structure and spectral properties of maleimide derivatives #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 #11.永續城市與社區 2018-04-09
093 / 1 Accurate prediction of electro-luminescent properties in red emission DCM, DCJ, RED and DAD derivatives. 2011-10-15
089 / 2 Production of carbon nanotubes in air 2012-03-02
086 / 2 The free-OH stretching frequencies of 3-coordinated H2O in water clusters and on ice surfaces 2012-05-24
100 / 2 Synthesis of 6-(4-diethylamino)phenyl-2-oxo-2H-pyran-3-carbonitorile derivatives and their fluorescence in solid state and in solutions 2017-03-29
100 / 1 Photophysical properties of arylcarbonitrile derivatives: Synthesis, absorption and emission spectra, and quantum chemical studies 2014-09-15
099 / 2 DFT and TD-DFT investigations of metal-free dye sensitizers for solar cells: Effects of electron donors and π-conjugated linker 2014-03-04
101 / 2 Photo-physical Properties of N-methyl-3,4-fulleropyrrolidine and Its Derivatives: A DFT and TD-DFT Investigation 2014-03-04
092 / 1 Theoretical investigation of electroluminescent material 1,4-distyrylbenzene derivatives 2013-03-12
082 / 1 碳結構的新發現--巴式管 2013-04-11
080 / 1 高溫超導體之探討 2013-04-11
079 / 1 淺談化學公式中的對稱觀念 2013-04-11
085 / 1 球烯氧化物C60O和C70O的理論探討 2013-04-11
083 / 2 C20-C40小球烯的結構特性 #03.良好健康和福祉 #07.可負擔的潔淨能源 #11.永續城市與社區 2018-04-16
084 / 1 Carbon Nanotubes形成機制之探討 2013-04-11
081 / 1 神奇的球烯分子--利用簡單的規則預測其可能的穩定結構 2013-04-11
096 / 2 Localized Gaussian Type Orbital−Periodic Boundary Condition−Density Functional Theory Study of Infinite-Length Single-Walled Carbon Nanotubes with Various Tubular Diameters 2013-06-13
099 / 2 Effect of passivants in energy gap of Si47X24Y36 nano-clusters: A theoretical investigation 2015-01-22
082 / 1 Calculations on Heterofullerenes: C24 N4,C36 N4 and C52 N4 #03.良好健康和福祉 #04.優質教育 #12.負責任的消費與生產 2018-04-16
095 / 1 QSAR Analysis of the Lipid Peroxidation Inhibitory Activity with Structure and Energetics of 36 Flavonoids Derivatives 2017-03-21
080 / 2 The Exact Icosahedral Symmetry Relations for Atomic Overlaps, Molecular Orbitals and Vibrational Species of C60 Buckyballs 2017-04-27
099 / 1 Pharmacophore Modeling of Tyrosine Kinase Inhibitors: 4-Anilinoquinazoline Derivatives 2017-03-09
083 / 2 Dissolution and reduction behavior of C60 films 2013-08-08
085 / 2 Synthesis, spectroscopic and magnetic properties of the charge-transfer complex Bifc.C60 2013-08-08
102 / 2 Theoretical investigation of conformational stabilities and 13C NMR chemical shifts of a seven-membered ring thiosugar, (3R,4R,5R,7S)-7-(hydroxymethyl)thiepane-3,4,5-triol #03.良好健康和福祉 #04.優質教育 #08.尊嚴就業與經濟發展 #09.產業創新與基礎設施 2014-05-02
102 / 2 A Theoretical Investigation of low energy band gap polymers: polythiophene systems 2015-12-03
102 / 2 Edge-Termination and Core-Modification Effects of Hexagonal Nanosheet Graphene #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 2024-03-11
102 / 1 Substituted group and side chain effects for the porphyrin and zinc(II)–porphyrin derivatives: A DFT and TD-DFT study 2015-03-12
102 / 2 Towards Relative Populations of Non-Isomeric Metallofullerenes: La@C76(Td) vs. La2@C76(Cs, 17490) 2017-10-30
100 / 2 Modeling of Conjugated Heat Transfer in Direct-Contact Membrane Distillation of Seawater Desalination Systems 2024-02-21
100 / 2 Conformational analysis of a seven-membered ring azasugar, (3R,4R,6S)-trihydroxyazepane: Comparison of GIAO calculation and experimental NMR spectra on 13C chemical shifts 2022-12-28
103 / 1 Novel dipolar 5,5,10,10-tetraphenyl-5,10-dihydroindeno[2,1-a]-indene derivatives for SM-OPV: A combined theoretical and experimental study 2014-12-12
102 / 2 Blue fluorescent dihydro-indenoindene derivatives with unusual low oxidation potentials as multifunctional OLED materials 2015-04-14
084 / 1 A semiempirical study of C24N4 and its boron-nitrogen analogs 2015-06-03
104 / 1 Evaluation of the teratogenic effects of three traditional Chinese medicines, Si Jun Zi Tang, Liu Jun Zi Tang and Shenling Baizhu San, during zebrafish pronephros development #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 2024-03-21
104 / 1 2-Pyridone-based fluorophores containing 4-dialkylamino-phenyl group: Synthesis and fluorescence properties in solutions and in solid state #03.良好健康和福祉 #04.優質教育 #08.尊嚴就業與經濟發展 #09.產業創新與基礎設施 2018-03-27
104 / 2 Synthesis of Indeno[1,2-d]pyrimidin-5-Ones and Their Fluorescence in Solid State 2016-09-20
105 / 1 Density functional analysis of gaseous molecules adsorbed on metal ion/defective nano-sheet graphene #04.優質教育 #08.尊嚴就業與經濟發展 #09.產業創新與基礎設施 2018-04-16
104 / 2 Synthesis and stability study of isocyano aryl boronate esters and their synthetic applications 2017-05-02
105 / 2 Study on the alkaline stability of imidazolium and benzimidazolium based polyelectrolytes for anion exchange membrane fuel cells #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 #12.負責任的消費與生產 2017-09-20
104 / 2 Electronic and photophysical properties of the bend D-T-A-T-D derivatives for small-molecule organic photovoltaic (SM-OPV) solar cells: a DFT and TD-DFT investigation #03.良好健康和福祉 #07.可負擔的潔淨能源 #11.永續城市與社區 2024-04-12
103 / 2 Synthesis of indeno [1,2-d] pyrimidin-5-ones and their fluorescence in solid state: Synthesis of indeno [1,2-d]pyrimidin-5-ones and their fluorescence in solid state #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 2017-10-30
107 / 1 Rational design of cost-effective dyes for high performance dye-sensitized cells in indoor light environments #03.良好健康和福祉 #04.優質教育 #08.尊嚴就業與經濟發展 #09.產業創新與基礎設施 2021-12-30
106 / 1 Novel thienoisoindigo-based dyes for near-infrared organic photovoltaics - A combination of theoretical and experimental study #03.良好健康和福祉 #08.尊嚴就業與經濟發展 #09.產業創新與基礎設施 #17.夥伴關係 2021-12-30
107 / 2 Theoretical Study of 5,10-diphenylindeno[2,1-a]indene (DPI) dyes for Dye Sensitized Solar Cells (DSSC) #03.良好健康和福祉 #09.產業創新與基礎設施 #12.負責任的消費與生產 2019-09-17
106 / 1 Optimized geometry, electronic structure and Ag adsorption property of nanosheet graphene with different symmetry shapes: a theoretical investigation #03.良好健康和福祉 #04.優質教育 #09.產業創新與基礎設施 #12.負責任的消費與生產 2019-09-17