Donald G. Truhlar
University of Minnesota
402 papers found
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The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry
UploadLinearized Pair-Density Functional Theory
UploadSoftware for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
Download from zenodo.orgMulticonfiguration Density-Coherence Functional Theory
UploadNew density-functional approximations and beyond: general discussion
UploadNew approaches to study excited states in density functional theory: general discussion
UploadChallenges for large scale simulation: general discussion
UploadFluorine-free water-in-ionomer electrolytes for sustainable lithium-ion batteries
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