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1دورية أكاديمية
المؤلفون: Shufen Wang, Jinrou Wei, Hongzhao Xie, Xiaopeng Chen, Jie zhen Liang, Xiaojie Wei, Jie Huang, Linlin Wang
مصطلحات موضوعية: Immunology, Environmental Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, van ness test, saturated vapor pressure, phase equilibrium relationships, headspace gas chromatography, correlated using nrtl, activity coefficient models, systems almost triples, experimental temperature increases, pine resin systems, like screening model, contain resin acid, resin systems, sesquiterpene systems, resin tapping, abietic acid, experimental values, thermodynamic consistency, real solvents, positive capacity, gc ), correlation results, bvocs ), azeotropic behavior
الإتاحة: https://doi.org/10.1021/acs.iecr.3c04175.s001Test
https://figshare.com/articles/journal_contribution/Vapor_Liquid_Equilibrium_of_Monoterpene-Sesquiterpene_System_Containing_Resin_Acid/25339524Test -
2دورية أكاديمية
المؤلفون: Haomin Wu, YingYing Jiang, Chen Shen, Yuanhui Ji
مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Pharmacology, Biotechnology, Hematology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, polymer aqueous solution, polyethylene glycol 6000, average relative deviations, mixed solutions measuring, binary mixtures within, drug formulation development, different solvent systems, mixed solvents, hplc within, drug development, different compositions, binary solvents, various stages, uv spectrophotometry, ternary system, prediction accuracy, polyvinylpyrrolidone k30, phase behavior, organic solvents, molecular weight, gravimetrical method, experimental values
الإتاحة: https://doi.org/10.1021/acs.jced.3c00564.s007Test
https://figshare.com/articles/journal_contribution/Measurement_and_Thermodynamic_Modeling_of_Oxaprozin_Solubility_in_Polymers_and_Mixed_Solutions/25342506Test -
3دورية أكاديمية
المؤلفون: Biswajit Pal, Abhijeet J. Kale, Minakshi Sharma, K. C. Bhamu, Sung Gu Kang, Vijay K. Singh, Ambesh Dixit
مصطلحات موضوعية: Biophysics, Medicine, Neuroscience, Pharmacology, Ecology, Space Science, Environmental Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, visible spectrum range, circuit voltage (<, calculated indirect bandgaps, 53 %, respectively, junction solar cells, junction solar cell, – p structure, dos ), optical, band bending occurs, reported experimental values, ordered double perovskites, nio sc configuration, 6 sub, 2 sub, 5 sup, also substantiated using, ordered double, junction scs
الإتاحة: https://doi.org/10.1021/acs.energyfuels.3c03030.s001Test
https://figshare.com/articles/journal_contribution/Inorganic_Cs_sub_2_sub_TeX_sub_6_sub_X_Cl_Br_I_Lead-Free_Vacancy-Ordered_Double-Perovskite_Absorber-Based_Single-Junction_Solar_Cells_with_a_Higher_Efficiency_of_24_Theoretical_Insights/24923837Test -
4دورية أكاديمية
المؤلفون: Li Du, Ying Zeng, Xudong Yu, Wenzhang Zuo, Feng Zhang, Longjie Sun, Wenyu Yang
مصطلحات موضوعية: Medicine, Microbiology, Inorganic Chemistry, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, solid phases sylvite, isothermal dissolution method, buried polyhalite resources, related phase diagrams, phase diagram consists, 8 crystallization regions, ternary system k, 4 sub, quaternary system k, ternary systems k, kcl · mgcl, 2 sub, quaternary system, phase diagram, crystallization regions, ternary subsystems, phase equilibria, 2 k, crystallization region, simple systems, results showed, measured experimentally, grow significantly, experimental values
الإتاحة: https://doi.org/10.1021/acs.jced.3c00660.s001Test
https://figshare.com/articles/journal_contribution/Solid_Liquid_Phase_Equilibria_of_the_Aqueous_Quaternary_System_K_sup_sup_Mg_sup_2_sup_Cl_sup_sup_SO_sub_4_sub_sup_2_sup_-H_sub_2_sub_O_at_i_T_i_363_2_K/25041458Test -
5دورية أكاديمية
المؤلفون: Hao Du, Masahiro Sato, Atsushi Komuro, Ryo Ono
مصطلحات موضوعية: Medicine, Microbiology, Environmental Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, dlpno – ccsd, tzvp theory level, resulting rate constants, predicted rate constants, ζ basis set, study also demonstrated, obtaining theoretical values, computational resources required, abstraction reaction probabilities, rate constants, reaction probabilities, computational resources, theoretical prediction, state theory, experimental values, principles calculations, performed based, oh radicals, method used, large amount, hybrid functionals, high accuracy, error factors, could reproduce
الإتاحة: https://doi.org/10.1021/acs.jpca.3c07531.s001Test
https://figshare.com/articles/journal_contribution/Theoretical_Prediction_of_the_Reaction_Probabilities_of_H_O_and_OH_Radicals_on_the_Polypropylene_Surface/25144023Test -
6دورية أكاديمية
مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Cancer, Space Science, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, low statistical uncertainty, corresponding experimental values, 42 khz ), phase rotational spectrum, ground vibrational state, future laboratory spectroscopy, transition frequencies presented, energy fundamental states, >- type transitions, >< sub ><, 5 sub, 27 sub, fit sub, 1 ‑ cyano, >< sub, rotational spectroscopy, state hamiltonians, squares fit, interacting states, energy overtone, via <, v <, b <
الإتاحة: https://doi.org/10.1021/acs.jpca.3c08002.s001Test
https://figshare.com/articles/journal_contribution/Rotational_Spectroscopy_of_1_Cyano-2-methylenecyclopropane_C_sub_5_sub_H_sub_5_sub_N_A_Newly_Synthesized_Pyridine_Isomer/25222207Test -
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المؤلفون: Chesnokov, A., Gryaznov, D., Skorodumova, Natalia, Kotomin, E. A., Zitolo, A., Zubkins, M., Kuzmin, A., Anspoks, A., Purans, J.
المصدر: Journal of Materials Chemistry C. 9(14):4948-4960
مصطلحات موضوعية: Atoms, Calculations, Coordination reactions, Electronic structure, Fermi level, II-VI semiconductors, Ions, Iridium, Monte Carlo methods, Oxidation, Oxide minerals, Peroxides, Seebeck coefficient, Thermoelectric equipment, Thermoelectricity, Thin films, X ray absorption spectroscopy, Zinc oxide, Electrical conductivity, Experimental values, Interstitial oxygen, Local atomic structures, Octahedral coordination, Reverse monte carlo simulation, Thermoelectric properties, Valence-band maximums, Density functional theory
وصف الملف: print
الوصول الحر: https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-308869Test
https://doi.org/10.1039/d1tc00223fTest -
8دورية أكاديمية
المؤلفون: Wenwu Jiang, Reut Sofer, Xiang Gao, Alexandre Tkatchenko, Leeor Kronik, Wengen Ouyang, Michael Urbakh, Oded Hod
مصطلحات موضوعية: Biophysics, Medicine, Neuroscience, Biotechnology, Ecology, Infectious Diseases, Computational Biology, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, transition metal dichalcogenide, thermal transport properties, calculated phonon spectra, binding energy curves, bilayer systems within, available experimental values, body dispersion treatment, heterogeneous tmd interfaces, heterogeneous interfaces, previous dispersion, layered interfaces, various junctions, training set, scale simulations, reference calculations, range correlation, previous parametrization, nonlocal many, large set, junctions outside, interlayer interactions
الإتاحة: https://doi.org/10.1021/acs.jpca.3c04540.s001Test
https://figshare.com/articles/journal_contribution/Anisotropic_Interlayer_Force_Field_for_Group-VI_Transition_Metal_Dichalcogenides/24525412Test -
9دورية أكاديمية
المؤلفون: Yi Lixi
مصطلحات موضوعية: Biophysics, Medicine, Genetics, Biotechnology, Cancer, Computational Biology, Space Science, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, Information Systems not elsewhere classified, two thermophysical properties, simulate thermophysical properties, make practical sense, critical carbon dioxide, providing reference settings, molecular dynamics simulation, scale particle system, 2 sub, simulation parameter determination, diffusion simulation results, approaching goal values, parameter settings, trial simulation, simulation converging, measured values, experimental values, theoretically confirmed, physical aspects, obtained settings
الإتاحة: https://doi.org/10.1021/acsomega.3c06752.s001Test
https://figshare.com/articles/journal_contribution/Feasible_Molecular_Dynamics_Simulation_and_Consistency_of_Critical_Carbon_Dioxide_Thermophysical_Properties/24846060Test -
10دورية أكاديمية
المؤلفون: Ji-Jun Zeng, Bo Zhao, Yu An, Xiao-Bo Tang, Sheng Han, Zhi-Qiang Yang, Wei Zhang, Jian Lu
مصطلحات موضوعية: Biophysics, Biotechnology, Immunology, Environmental Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, thermal expansion coefficient, nuclear magnetic resonance, lattice potential energy, ionic liquids ”, emim ][ bf, standard molar entropy, 15 – 358, viscosity activation energy, 3 sub, surface entropy, 15 k, “ good, walden rule, surface tension, surface enthalpy, physicochemical properties, experimental values, empirical equations, elemental analysis, dependent viscosity, ambient conditions
الإتاحة: https://doi.org/10.1021/acsomega.3c05697.s001Test
https://figshare.com/articles/journal_contribution/Synthesis_Characterization_and_Physicochemical_Properties_of_New_Emim_BF_sub_3_sub_X_Complex_Anion_Ionic_Liquids/24847821Test