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Inorganic Chemistry

Working Paper

Unlocking Phase Diagrams for Molybdenum and Tungsten Nanoclusters and Prediction of their Formation Constants

Enric Petrus, Carles Bo

Version 1 posted 25 March 2021

405

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Physical Chemistry

Working Paper

Solvation and Speciation of Cobalt(II). A Theoretical X-Ray Absorption and RIXS Study

Basmah H. Allehyani, Walid I. Hassan, Saadullah Aziz, Rifaat H. Hilal, Oliver Kühn, Sergey I. Bokarev

Version 2 posted 21 January 2020

873

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Energy

Working Paper

Conditioning–Free Electrolytes for Magnesium Batteries Using Sulfone–Ether Mixtures with Increased Thermal Stability

Laura C. Merrill, Jennifer Schaefer

Version 1 posted 16 May 2018

792

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Earth, Space, and Environmental Chemistry

Working Paper

Direct Observations of Anthracene Clusters at Ice Surfaces

Subha Chakraborty, Annastacia Stubbs, Tara Kahan

Version 1 posted 06 September 2021

301

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Earth, Space, and Environmental Chemistry

Review

Structural and thermodynamic properties of La3+ in chloride-bearing hydrothermal fluids - Insights from a new ab initio-based polarizable force field

Rajorshi Chattopadhyay, Sandro Jahn

Version 1 posted 20 March 2025

39

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Catalysis

Working Paper

Porphyrin Aggregation under Homogeneous Conditions Inhibits Electrocatalysis: A Case Study on CO₂ Reduction

Kaitlin Branch, Erin Johnson, Eva Nichols

Version 1 posted 25 January 2024

496

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Inorganic Chemistry

Working Paper

Computational Prediction of Speciation Diagrams and Nucleation Mechanisms: Molecular Vanadium, Niobium and Tantalum Oxide Nanoclusters in Solution

Enric Petrus, Mireia Segado-Centellas, Carles Bo

Version 1 posted 08 March 2022

431

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Aqueous Speciation of Tetravalent Actinides in the Presences of Chloride and Nitrate Ligands

Rameswar Bhattacharjee, Pere Miro

Version 1 posted 14 June 2022

221

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Inorganic Chemistry

Working Paper

Flow Battery Electroanalysis 4: Investigation of Speciation and Correlated Electron Transfer Kinetics of the Cr(III/II) Redox Couple for Functional Flow Batteries

Becca Segel, Zachary Parr, James McKone

Version 1 posted 25 March 2025

48

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9 results in Speciation in Keywords: Speciation

Unlocking Phase Diagrams for Molybdenum and Tungsten Nanoclusters and Prediction of their Formation Constants

Solvation and Speciation of Cobalt(II). A Theoretical X-Ray Absorption and RIXS Study

Conditioning–Free Electrolytes for Magnesium Batteries Using Sulfone–Ether Mixtures with Increased Thermal Stability

Direct Observations of Anthracene Clusters at Ice Surfaces

Structural and thermodynamic properties of La3+ in chloride-bearing hydrothermal fluids - Insights from a new ab initio-based polarizable force field

Porphyrin Aggregation under Homogeneous Conditions Inhibits Electrocatalysis: A Case Study on CO₂ Reduction

Computational Prediction of Speciation Diagrams and Nucleation Mechanisms: Molecular Vanadium, Niobium and Tantalum Oxide Nanoclusters in Solution

Aqueous Speciation of Tetravalent Actinides in the Presences of Chloride and Nitrate Ligands

Flow Battery Electroanalysis 4: Investigation of Speciation and Correlated Electron Transfer Kinetics of the Cr(III/II) Redox Couple for Functional Flow Batteries

9 results in Keywords: Speciation