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Computational Chemistry Column: What is Computational Chemistry? A Tentative Answer
J. Weber, H. Huber, H. P. Weber
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Emerging Trends of Computational Chemistry and Molecular Modeling in Froth Flotation: A Review. [PDF]
Alizadeh Sahraei A+4 more
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The plasma edge of transparent conducting oxide SrNbO3 shifts from ∼2 eV in the visible range to 1.37 eV in the near‐infrared region by off‐stoichiometry using the vacancy sites as quasi‐substitutional virtual elements. This work advances the stoichiometry engineering of perovskite oxides using oxide molecular beam epitaxy, allowing synthesis beyond ...
Jasnamol Palakkal+11 more
wiley +1 more source
Bioinformatics and computational chemistry approaches to explore the mechanism of the anti-depressive effect of ligustilide. [PDF]
Zhang K+4 more
europepmc +1 more source
Registering the Amica electronic structure code in the Extensible Computational Chemistry Environment [PDF]
Robert J. Gdanitz+4 more
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In this work, melt electrowriting is used to fabricate a 3D printed scaffold design that generates engineered cardiac tissues with in‐plane contraction, mimicking natural myocardium. It is shown that these tissues display advanced maturation and functionality.
Olalla Iglesias‐García+23 more
wiley +1 more source
Progresses Towards the Advanced Computational Chemistry of Increasingly Complex Systems
Jacques Weber
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Computational Chemistry Using the PC, 3rd Edition (Donald W. Rogers) [PDF]
Andrew J. Pounds
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