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1
Development of Integration Techniques for Semiempirical Quantum Chemistry Methods and Density Functional Theory
Development of Integration Techniques for Semiempirical Quantum Chemistry Methods and Density Functional Theory
Peels, Mieke. | The Pennsylvania State University | 2020
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2
Investigations of the Electronic Structures of Multimetallic Iron-Chalcogenide Clusters and Five-Coordinate Cobalt Complexes
Investigations of the Electronic Structures of Multimetallic Iron-Chalcogenide Clusters and Five-Coordinate Cobalt Complexes
SantaLucia, Daniel John. | The University of Wisconsin - Madison | 2021
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3
Virtual Experiments and Designs of Composites with the Inclusion-Based Boundary Element Method (iBEM)
Virtual Experiments and Designs of Composites with the Inclusion-Based Boundary Element Method (iBEM)
Wu, Chunlin. | Columbia University | 2021
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4
In Silico Chemistry: Multiscale Modeling from Quantum Mechanics to Kinetics
In Silico Chemistry: Multiscale Modeling from Quantum Mechanics to Kinetics
Ford, Jason Elliot. | Stanford University | 2020
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5
Advancing Quantum Chemistry Simulations with Relativistic Electronic Structure and Quantum Computation
Advancing Quantum Chemistry Simulations with Relativistic Electronic Structure and Quantum Computation
Stetina, Torin F. | University of Washington | 2021
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6
Quantum Mechanical Approaches towards Understanding Charge Transfer in Chemical Systems
Quantum Mechanical Approaches towards Understanding Charge Transfer in Chemical Systems
Ranya, Srinath. | Cornell University | 2021
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7
Chern-Simons Theory beyond Topology: Partition Functions on Manifolds with Boundary
Chern-Simons Theory beyond Topology: Partition Functions on Manifolds with Boundary
Yu, Cheuk Yin. | New York University | 2021
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8
Singlet Fission: A Twisted Tale
Singlet Fission: A Twisted Tale
Conrad-Burton, Felisa. | Columbia University | 2021
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