|
Dicationic ionic liquids/heteropoly acid composites as heterogeneous catalysts for cyclohexene oxidation with molecular oxygen under solventfree condition Insights from theory and experiments
|
# |
|
|
Average drift time and average mobility in ion mobility spectrometry
|
# |
|
|
Perrhenate-Catalyzed Deoxydehydration of a Vicinal Diol A Comparative Density Functional Theory Study
|
10.1021/acs.jpca.7b08884 |
|
|
Synthesis Structure DNA/Protein Binding and Cytotoxic Activity of a Rhodium(III) Complex with 2 6-Bis(2-benzimidazolyl)pyridine
|
# |
|
|
Effect of helium nanoclusters on the spectroscopic properties of embedded SF6 Ionization excitation and vibration
|
# |
|
|
Galvanic exchange at layered doubled hydroxide/N-doped graphene as an in-situ method to fabricate powerful electrocatalysts for hydrogen evolution reaction
|
# |
|
|
A new force field for the adsorption of H2 O2 N2 CO H2O and H2S gases on alkali doped carbon nanotubes
|
# |
|
|
Intermolecular interaction of guanidine and 2H-tetrazole Enthalpy formation of guanidinium tetrazolate in the gas phase
|
# |
|
|
Linear Yukawa Isotherm Regularity for dense fluids derived based on the perturbation theory
|
# |
|
|
Experimental and ONIOM computational evaluation of DNA- and BSA-binding and cytotoxic activity of a mononuclear Pd(II) complex with piroxicam
|
# |
|
|
Theoretical Modeling of the Chirality Discrimination of Enantiomers by Nanotubular Cyclic Peptides using Gas-Phase PhotoelectronSpectroscopy An ONIOM Spectroscopic Calculations
|
# |
|
|
Regioselective Heck reaction catalyzed by Pd nanoparticles immobilized on DNA-modified MWCNTs
|
# |
|
|
Electrocatalytic reduction of CO2 to CO by a mononuclear Ru(II) complex
|
# |
|
|
New potential energy surface and rovibrational spectra of Ar HCl complex An ab initio study
|
# |
|
|
Ionization energies electron affinities and binding energies of Li-doped gold nanoclusters
|
# |
|
|
Molecular thermodynamic modeling of ionic liquids using the perturbation-based linear Yukawa isotherm regularity
|
# |
|
|
Towards new thermodynamic regularities for dense fluids based on the effective attraction pair potential via the perturbation theory
|
# |
|
|
Adsorption of some important tautomers of 5-amino tetrazole on the (001) and (101) surfaces of anatase Theoretical study
|
# |
|
|
Ionization of vitamin C in gas phase Theoretical study
|
# |
|
|
In situ generation of the gold nanoparticles-bovine serum albumin (AuNPseBSA) bioconjugated system using pulsed-laser ablation (PLA)
|
# |
|