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Research Outputs
THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS
Journal
Identifier:
E201012
ISSN:
1948-7185
Overview
Overview
Research Outputs (30)
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A Cost-Effective Semi-Ab Initio Approach to Model Relaxation in Rare-Earth Single-Molecule Magnets
Academic Article
Accurate Quantum Chemical Free Energies at Affordable Cost
Academic Article
Coherent Spin Dynamics in Molecular Cr8Zn Wheels
Academic Article
Collective Variables from Local Fluctuations
Academic Article
Dominant Role of Quantum Anharmonicity in the Stability and Optical Properties of Infinite Linear Acetylenic Carbon Chains
Academic Article
Effect of Anesthesia Gases on the Oxygen Reduction Reaction
Academic Article
Electron Spin Polarization and Rectification Driven by Chiral Perylene Diimide-Based Nanodonuts
Academic Article
Evidence of Multiple Crystallization Pathways in Lithium Disilicate: A Metadynamics Investigation
Academic Article
How the Reorganization Free Energy Affects the Reduction Potential of Structurally Homologous Cytochromes
Academic Article
Hydrogen bond dynamics of methyl acetate in methanol
Academic Article
Identifying Slow Molecular Motions in Complex Chemical Reactions
Academic Article
Limits of the Classical Concept of Concentration
Academic Article
Magnetic field-induced alignment of molecular rotor-shaped cyclophanes
Academic Article
Mechanistic View on the Order-Disorder Phase Transition in Amphidynamic Crystals
Academic Article
On the Aromatic Character of 1,2-Dihydro-1,2-azaborine2 According to Magnetic Criteria
Academic Article
Optical Excitations and Field Enhancement in Short Graphene Nanoribbons
Academic Article
Optical Properties and Charge-Transfer Excitations in Edge-Functionalized All-Graphene Nanojunctions
Academic Article
Oxygen Evolution and Reduction on Two-Dimensional Transition Metal Dichalcogenides
Academic Article
Photoprotecting Uracil by Coupling with Lossy Nanocavities
Academic Article
Self-Trapped Excitons in Metal-Halide Perovskites Investigated by Time-Dependent Density Functional Theory
Academic Article
Signatures of Small Morphological Anisotropies in the Plasmonic and Vibrational Responses of Individual Nano-objects
Academic Article
Systematic Assessment of the Accuracy of Subunit Counting in Biomolecular Complexes Using Automated Single-Molecule Brightness Analysis
Academic Article
Terahertz Spectroscopy Unambiguously Determines the Orientation of Guest Water Molecules in a Structurally Elusive Metal–Organic Framework
Academic Article
The Active Site Loop Modulates the Reorganization Energy of Blue Copper Proteins by Controlling the Dynamic Interplay with Solvent
Academic Article
The Reorganization Energy in Cytochrome c is Controlled by the Accessibility of the Heme to the Solvent
Academic Article
The Role of the Electron Spin Polarization in Water Splitting
Academic Article
Two-Dimensional Electronic Spectroscopy Reveals Dynamics and Mechanisms of Solvent-Driven Inertial Relaxation in Polar BODIPY Dyes
Academic Article
Ultrafast Formation of Small Polarons and the Optical Gap in CeO2
Academic Article
Variational Flooding Study of a SN2 Reaction
Academic Article
Vibronic Coupling Drives the Ultrafast Internal Conversion in a Functionalized Free-Base Porphyrin
Academic Article
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