TY - RPRT TI - Density Functionals for Hydrogen Storage: Defining the H2Bind275 Test Set with Ab Initio Benchmarks and Assessment of 55 Functionals AU - Veccham, Srimukh Prasad AU - Head-Gordon, Martin PY - 2020 DO - 10.1021/acs.jctc.0c00292 UR - https://www.osti.gov/biblio/1779251 ID - 1779251 ER -