00862nam a22001697a 4500040003600000082001300036100002400049245013500073260003500208300004100243500015600284500004000440500003900480502006000519546001200579650010100591  cRiphah International University  a530bSAN  aSanum saeed (32853)  aInsights of density-functional quantum computations on thermodynamic properties of Mo-doped MgH2 for hydrogen-storage applications  aIslamabadb(unpublished)c2023  axv, 55p.b: ill. Col.c; 30 cm.e+CD  aA dissertation submitted in the partial fulfillment of the requirements for the degree of Master of Philosophy in Physics Department of Basic Sciences.  aIncludes bibliographical references  aThesis supervisor: Dr. Azmat Iqbal  aThesis (M.Phil.)--Riphah International University, 2023  aEnglish  aPhysics vMetal hydridesvMagnesim hydridesvMechanical modificationsvThermodynamicsvDBSvFEAS