Vibrational spectroscopic investigation (FT-IR and FT-Raman) on 1,2-dibromobenzene by HF and hybrid (LSDA and B3LYP) calculations

Designing Solid Electrolyte Interfaces towards Homogeneous Na Deposition: Theoretical Guidelines for Electrolyte Additives and Superior High‐Rate Cycling Stability

“…Meanwhile, experimental evidence acquired from Raman spectra verifies AIMD results and ESP analysis. With the increase of the amount of 1,2‐DBB, the characteristic peak intensities of 1,2‐DBB become larger in various electrolytes, [18] and no new peaks and peaks shift are observed (Figure 3g), indicating that the solvation structure of the electrolyte is not changed by 1,2‐DBB.…”

Synergistic stabilization of shale by a mixture of polyamidoamine dendrimers modified bentonite with various generations in water-based drilling fluid

“…The bands at 1650 cm −1 and 1560, 1550 cm −1 were the C = O stretching vibration and C-N bending vibration respectively, corresponding to the characteristic absorption bands of amide I and amide II (Schmidt et al, 2006). The bands at 1460 and 1360 cm −1 indicated the C-H asymmetric and symmetric bending vibration, and the bands at 1110, 1120 and 1130 cm −1 were attributed to C-H inplane bending vibration (Shakila et al, 2012), CH 2 twisting vibration and C-N symmetric stretching vibration, respectively (Minitha et al, 2011;Wan et al, 2011).…”