机译:探索R-Br中心点中心点中心点圆周率的(非常平坦)势能景观 与精确CCSD(T)和SAPT技术的相互作用
Xavier Univ Louisiana, Dept Chem, 1 Dr Drexel, New Orleans, LA 70125 USA;
Texas A&M Univ, Dept Chem, POB 30012, College Stn, TX 77842 USA;
ab initio calculations; crystal engineering; halogen bonding; noncovalent interactions; protein-ligand complexes;