Results 231 to 240 of about 112,578 (285)

Green Spectrofluorometric Method for Labetalol Determination Based on Electron Transfer Inhibition With Density Functional Theory Validation and Statistical Design Optimization. [PDF]

Luminescence
Al Shmrany H, Alqahtani A, Alqahtani T, Alshehri A, Almrasy AA.   +4 more
europepmc   +1 more source

Tuning CO₂ electroreduction to methane <i>via</i> oxygen termination of M₂BO₂ (M = V, Cr, Hf, Mo, Ta, W) MBene catalysts: a DFT + U investigation. [PDF]

RSC Adv
Ali JM, Obodo KO, Mohammed AM, Mekonnen YS.   +3 more
europepmc   +1 more source

Unveiling the effects of tautomerism, pH, and solvation on the UV/Vis spectrum of sulfapyridine: a joint theoretical and experimental study. [PDF]

J Mol Model
Santos JLF, Sales LCP, Souza FL, de Souza GLC, Roitberg AE, Haiduke RLA.   +5 more
europepmc   +1 more source

QM/MM Modeling of the Electronic Structure and Properties of the Fe-S Clusters in <i>Desulfovibrio desulfuricans</i> [FeFe]-Hydrogenase. [PDF]

Inorg Chem
Rovaletti A, Wu-Lu M, Arrigoni F, De Gioia L, Ryde U, Greco C, Bertini L.   +6 more
europepmc   +1 more source

Rh/Ru-Catalyzed Asymmetric One-Pot Sequential Hydrogenation: Stereodivergent Synthesis of Chiral 1,3-Amino Alcohol Derivatives. [PDF]

JACS Au
He J, Luo Y, Li W, Liu D, Zhang W.
europepmc   +1 more source

The underlying event in proton-proton collisions

, 2009
openaire   +2 more sources

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Theory of Scattering of Protons by Protons

Physical Review, 1936
The experiments of Tuve, Heydenburg and Hafstad and those of White are discussed by means of the standard theory of scattering in central fields. The theoretical formulas are presented in a form convenient for numerical computation and are supplemented by tables.
Breit, G., Condon, E. U., Present, R. D.
openaire   +1 more source

Proton–proton correlations observed in two-proton radioactivity of 94Ag

Nature, 2006
The stability and spontaneous decay of naturally occurring atomic nuclei have been much studied ever since Becquerel discovered natural radioactivity in 1896. In 1960, proton-rich nuclei with an odd or an even atomic number Z were predicted to decay through one- and two-proton radioactivity, respectively.
Ivan Mukha, Ernst Roeckl, Leonid Batist, Andrey Blazhev, Joachim Döring, Hubert Grawe, Leonid Grigorenko, Mark Huyse, Zenon Janas, Reinhard Kirchner, LA COMMARA, MARCO, Chiara Mazzocchi, Sam L. Tabor, Piet Van Duppen   +13 more
openaire   +3 more sources

Proton Migration and Tautomerism in Protonated Triglycine

Journal of the American Chemical Society, 2001
Proton migration in protonated glycylglycylglycine (GGG) has been investigated by using density functional theory at the B3LYP/6-31++G(d,p) level of theory. On the protonated GGG energy hypersurface 19 critical points have been characterized, 11 as minima and 8 as first-order saddle points.
Rodriquez, CF, Cunje, A, Shoeib, T, Chu, IK, Hopkinson, AC, Siu, KWM   +5 more
openaire   +4 more sources