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Synonyms were used for: Chemie
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Engaging Students with the Real World in a Green Organic Chemistry Laboratory Group Project: A Presentation and Writing Assignment in a Laboratory Class
American Chemical Society | 2018|Keywords: Applications of Chemistry, Industrial Chemistry, Green Chemistry, Organic Chemistry -
Role of water in intramolecular proton transfer reactions of formamide and thioformamide
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Fluorene-imidazole dyes excited states from first-principles calculations—Topological insights
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Relativistic double-zeta, triple-zeta, and quadruple-zeta basis sets for the light elements H–Ar
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
A benchmark for the non-covalent interaction (NCI) index or… is it really all in the geometry?
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Benchmarking DFT-GGA calculations for the structure optimisation of neutral-framework zeotypes
Online Contents | 2016|Keywords: Computational chemistry, Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Solid state chemistry, Chemistry, Organic Chemistry -
Developing the Chemist’s Inner Coder: A MATLAB Tutorial on the Stochastic Simulation of a Pseudo-First-Order Reaction
American Chemical Society | 2020|Keywords: Computational Chemistry, Physical Chemistry -
Structural, electronic and optical properties of copper, silver and gold sulfide: a DFT study
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
On-Site Monitoring Indoor Air Quality in Schools: A Real-World Investigation to Engage High School Science Students
Free accessAmerican Chemical Society | 2020|Keywords: Analytical Chemistry, High School/Introductory Chemistry, Environmental Chemistry, Atmospheric Chemistry -
Facilitating Laboratory Research Experience Using Reticular Chemistry
American Chemical Society | 2018|Keywords: Analytical Chemistry, Physical Chemistry, Computational Chemistry, Inorganic Chemistry, Organic Chemistry -
Sodium adsorption and intercalation in bilayer graphene from density functional theory calculations
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Particle on a Ring Model for Teaching the Origin of the Aromatic Stabilization Energy and the Hückel and Baird Rules
Free accessAmerican Chemical Society | 2022|Keywords: Quantum Chemistry, Organic Chemistry, Introductory Chemistry, Physical Chemistry -
The complete basis set Full-CI roto-vibrational spectroscopic constants of AlH, $$\hbox {AlH}^{+}$$ AlH + and $$\hbox {AlH}^{-}$$ AlH
Online Contents | 2017|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Computational investigation on the endohedral borofullerenes M@B40 (M = Sc, Y, La)
Online Contents | 2015|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Photophysical properties prediction of selenium- and tellurium-substituted thymidine as potential UVA chemotherapeutic agents
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Encapsulation of small gas molecules and rare gas atoms inside the octa acid cavitand
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Host–guest chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Is NICS a reliable aromaticity index for transition metal clusters?
Online Contents | 2015|Keywords: Computational chemistry, Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Organic Chemistry -
Hirshfeld-I charges in linear combination of atomic orbitals periodic calculations
Online Contents | 2016|Keywords: Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Computational chemistry, Organic Chemistry -
Food Chemistry: A Model for Upper Level Chemistry Electives
American Chemical Society | 2018|Keywords: Applications of Chemistry, Consumer Chemistry, Plant Chemistry, Organic Chemistry, Agricultural Chemistry -
Density functional theoretical analysis of structure, bonding, interaction and thermodynamic selectivity of hexavalent uranium (UO2 2+) and tetravalent plutonium (Pu4+) ion complexes of tetramethyl diglycolamide (TMDGA)
Online Contents | 2015|Keywords: Computational chemistry, Theoretical and Computational Chemistry, Physical Chemistry, Theoretische Chemie, Inorganic Chemistry, Chemistry, Organic Chemistry
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