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The top documents of minh-tho
Rockstar
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The Boron conundrum: the case of cationic clusters B n + with n = 2–20
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Regiochemistry of 1,3-dipolar cycloadditions between azides and substituted ethylenes: a theoretical study
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Density Functional Approach to Regiochemistry, Activation Energy, and Hardness Profile in 1,3-Dipolar Cycloadditions
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Interactions of carbon dioxide with model organic molecules: A comparative theoretical study
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A Unified Perspective on the Hydrogen Atom Transfer and Proton-Coupled Electron Transfer Mechanisms in Terms of Topographic Features of the Ground and Excited Potential Energy Surfaces
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Theoretical modeling of optical properties of Ag8 and Ag14 silver clusters embedded in an LTA sodalite zeolite cavity
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The Exchange Coupling in Cr 3 O n ( n = 0−3) Clusters
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Design of aromatic heteropolycyclics containing borole frameworks
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Structure and stability of aluminium doped lithium clusters (LinAl0/+, n = 1–8): a case of the phenomenological shell model
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Free radical pathways for the prebiotic formation of xanthine and isoguanine from formamide
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Electronic Structure of Germanium Monohydrides Ge n H, n = 1−3
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A Stochastic Search for the Structures of Small Germanium Clusters and Their Anions: Enhanced Stability by Spherical Aromaticity of the Ge 10 and Ge 122− Systems
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Silole-based oligomers as electron transport materials
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Inversion Processes in Phosphines and Their Radical Cations: When Is a Pseudo-Jahn−Teller Effect Operative? †
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Remarkable Blue Shifts of C−H and N−H Stretching Frequencies in the Interaction of Monosubstituted Formaldehyde and Thioformaldehyde with Nitrosyl Hydride
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Fast Reactions of Hydroxycarbenes: Tunneling Effect versus Bimolecular Processes
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Mechanism and Kinetics of the Reaction of Acetylene and Nitric Oxide
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Lithium-Doped Germanium Nanowire? Experimental and Theoretical Indication
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