Matthias Loipersberger
Appearances
- SESSION: COMP POSTER SESSION:
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Speakers
Univ of California - DateMarch 24, 2022Energy gap-dependent regularization of second order Møller-Plesset theory can substantially improve its accuracy for two important classes of problems where it is believed to be inapplicable…
Presenter
University of California BerkeleySpeakers
- The computation of non-covalent interaction energies on noisy intermediate-scale quantum (NISQ) computers appears to be challenging with straightforward application of existing quantum algorithms…
- The computation of non-covalent interaction energies on noisy intermediate-scale quantum (NISQ) computers appears to be challenging with straightforward application of existing quantum algorithms…
- : [COMP] Division of Computers in Chemistry
Speakers
Florida State UniversityUniversity of California, MercedProf., University of PerugiaMichigan State UniversityPostdoctoral Researcher, Indiana UniversityIndiana UnivIndiana University BloomingtonVirginia Polytechnic Institute and State UniversityVirginia TechUniversity of Wisconsin-Madison College of Letters and Science - The computation of non-covalent interaction energies on noisy intermediate-scale quantum (NISQ) computers appears to be challenging with straightforward application of existing quantum algorithms…
- : [COMP] Division of Computers in Chemistry
Speakers
Florida State UniversityUniversity of California, MercedProf., University of PerugiaMichigan State UniversityPostdoctoral Researcher, Indiana UniversityIndiana UnivIndiana University BloomingtonVirginia Polytechnic Institute and State UniversityVirginia TechUniversity of Wisconsin-Madison College of Letters and Science - DateAugust 13, 2023Bonding models of gold(I) species have been crucial for the development of gold(I) catalysis. We describe the synthesis and characterization of the first gold(I)-cyclobutadiene complex, accompanied with bonding analysis by variational energy decomposition analysis methods…
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