https://www.selleckchem.com/pr....oducts/as2863619.htm
tical Procedure Index (GAPI) where the three tools confirmed the environmentally friendly nature of all proposed methods.Previous studies have shown that the weakly bonded H2S dimer demands high level quantum chemical calculations to reproduce experimental values. We investigated the hydrogen bonding of H2S dimer using MP2 and CCSD(T) levels of theory in combination with aug-cc-pV(D,T,Q)Z basis sets. More precisely, the binding energies, potential energy curves, rovibrational spectroscopic constants, decomposition lifetime, and normal
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