Browsing Fizik / Physics by Author "Gunay, N; Pir, H; Avci, D; Atalay, Y;"

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NLO and NBO Analysis of Sarcosine-Maleic Acid by Using HF and B3LYP Calculations

Avcı, Davut; Atalay, Yusuf (HINDAWI LTD, 2013)

We report a theoretical study on molecular structure, vibrational spectra, nonlinear optical (NLO), and natural bond orbital (NBO) analysis of sarcosine-maleic acid (C7H11NO6) in the ground state calculated by using the ...