Exploring NH3-NH3 Interactions: A Comparative Study of Force Field and CCSD(T)/QZVPP Calculations for Thermodynamic Analysis and Second Virial Coefficient in Gas-Phase Chemistry and Atmospheric Science
Journal of Solid State Chemistry（2025）
关键词
NH3-NH3 interactions,CCSD(T)/QZVPP calculations,Improved LJP(ILJP),SVC B,thermodynamics
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