نمایش نتایج جستجو برای
نام مجله: Physical Chemistry Chemical Physics
موارد یافت شده: 22
1 - Controlling product selectivity and catalyst lifetime by altering acid strength, cavity size of SAPO, and diffusion rate of methanol in the MTO reaction: DFT and MD calculations (چکیده)2 - Easy-axis rotation in ferromagnetic monolayer CrN induced by fluorine and chlorine functionalization (چکیده)
3 - Why does solvent treatment increase the conductivity of PEDOT : PSS? Insight from molecular dynamics simulations (چکیده)
4 - The protein-stabilizing effects of TMAO in aqueous and non-aqueous conditions (چکیده)
5 - Theoretical study on the absorption of carbon dioxide by DBU-based ionic liquids (چکیده)
6 - Does the addition of a heteropoly acid change the water percolation threshold of PFSA membranes? (چکیده)
7 - Evaluation and understanding the performances of various derivatives of carbonyl-stabilized phosphonium ylides in CO2 transformation to cyclic carbonates (چکیده)
8 - Mechanochemical reaction of Al and melamine: a potential approach towards the in situ synthesis of aluminum nitride–carbon nanotube nanocomposites (چکیده)
9 - Computational microscopy study of the granular structure and pH dependence of PEDOT:PSS (چکیده)
10 - Elucidating the morphological aspects and proton dynamics in a hybrid perfluorosulfonic acid membrane for medium-temperature fuel cell applications (چکیده)
11 - Electronic structure and optical properties of novel monolayer gallium nitride and boron phosphide heterobilayers (چکیده)
12 - Seawater desalination using pillared graphene as a novel nano-membrane in reverse osmosis process: nonequilibrium MD simulation study (چکیده)
13 - Morphology and ion diffusion in PEDOT:Tos. A coarse grained molecular dynamics simulation (چکیده)
14 - Electronic and optical properties of boron phosphide/blue phosphorus heterostructures (چکیده)
15 - Mechanochemical synthesis of nanostructured metal nitrides, carbonitrides and carbon nitride: a combined theoretical and experimental study (چکیده)
16 - Molecular dynamics simulation of amino acid ionic liquids near a graphene electrode: effects of alkyl side-chain length (چکیده)
17 - Proton transfer in acetylacetone and its alpha-halo derivatives (چکیده)
18 - Theoretical design of the cyclic lipopeptide nanotube as a molecular channel in the lipid bilayer, molecular dynamics and quantum mechanics approach (چکیده)
19 - Why is the electroanalytical performance of carbon paste electrodes involving ionic liquid binder higher than paraffinic binders? a simulation investigation (چکیده)
20 - A Combined Molecular Dynamic and Quantum Mechanic Study of the Solvent and Guest Molecule Effect on the Stability and Length of Heterocyclic Peptide Nanotube (چکیده)
21 - How a protein can remain stable in a solvent with high content of urea: Insights from molecular dynamics simulation of Candida antarcetica lipase B in urea:choline chloride deep eutectic solvent (چکیده)
22 - Synthesis and application of FePt/CNTs nanocomposite as a sensor and novel amide ligand as a mediator for simultaneous determination of glutathione, nicotinamide adenine dinucleotide and tryptophan (چکیده)
