Gaussian Job Archive for B2(2-) Henry S. Rzepa M J Harvey 10.6084/m9.figshare.92393.v1 https://figshare.com/articles/dataset/Gaussian_Job_Archive_for_B2_2-_/92393 <p>Gaussian Job Archive</p> 2012-06-15 14:13:32 InChI=1/B2H4/c1-2/h1-2H2 InChIKey=QSJRRLWJRLPVID-UHFFFAOYSA-N B#B B2(2-) opt CCSD(T)/aug-cc-pvqz Organic Chemistry