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Journal of Chemical Information and Modeling|July 9, 2026
A Numerical Implementation to Calculate Elastic Properties of Biological Membrane SimulationsDenys E S Santos, Vinicius Firmino, Ricardo L Longo, et al.Journal of Molecular Modeling|October 15, 2020
Overlap properties of chemical bonds in generic systems including unusual bonding situationsRenaldo T Moura, Albano N Carneiro Neto, Oscar L Malta, et al.Entropy (Basel, Switzerland)|September 27, 2024
Concentration Scales and Solvation Thermodynamics: Some Theoretical and Experimental Observations Regarding Spontaneity and the Partition RatioDiego J Raposo da Silva, Jéssica I R de Souza, Ricardo L LongoJournal of the American Chemical Society|October 31, 2012
Selectivity and mechanisms driven by reaction dynamics: the case of the gas-phase OH(-) + CH3ONO2 reactionMiguel A F de Souza, Thiago C Correra, José M Riveros, et al.Journal of Computational Chemistry|November 24, 2012
PICVib: an accurate, fast, and simple procedure to investigate selected vibrational modes at high theoretical levelsMarcus V P dos Santos, Eduardo C Aguiar, João Bosco P da Silva, et al.The Journal of Physical Chemistry Letters|February 3, 2021
Surface Plasmon-Photon Coupling in Lanthanide-Doped NanoparticlesXian Qin, Albano N Carneiro Neto, Ricardo L Longo, et al.Journal of Molecular Modeling|July 17, 2007
On the relative stabilities of the alkali cations 222 cryptates in the gas phase and in water-methanol solutionElisa S Leite, Sidney R Santana, Philippe H Hünenberger, et al.Chemical Communications (Cambridge, England)|October 29, 2008
Tristriazolotriazines: a core for luminescent discotic liquid crystalsRodrigo Cristiano, Hugo Gallardo, Adailton J Bortoluzzi, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|September 3, 2014
Dynamic effects dictate the mechanism and selectivity of dehydration-rearrangement reactions of protonated alcohols [Me2 (R)CCH(OH2 )Me](+) (R=Me, Et, iPr) in the gas phaseMiguel A F de Souza, Elizete Ventura, Silmar A do Monte, et al.Physical Chemistry Chemical Physics : PCCP|February 26, 2015
Features of chemical bonds based on the overlap polarizabilities: diatomic and solid-state systems with the frozen-density embedding approachRenaldo T Moura, Gian C S Duarte, Thiago E da Silva, et al.Pageof 4