Energy & Green Tech
Skoltech researchers have developed a novel material for lithium-ion batteries powering electric vehicles. With its ultrahigh energy density, the new cathode material promises longer driving ranges on one charge. Reported ...
Oct 18, 2022
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7
Energy & Green Tech
For decades, scientists have been searching for a catalyst that dramatically reduces the cost of fabricating hydrogen fuel cells.
Jul 7, 2022
1
11820
Computer Sciences
Pharmaceutical companies are using artificial intelligence to streamline the process of discovering new medicines. Machine-learning models can propose new molecules that have specific properties which could fight certain ...
Apr 26, 2022
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185
Electronics & Semiconductors
The photovoltaic effect of ferroelectric crystals can be increased by a factor of 1,000 if three different materials are arranged periodically in a lattice. This has been revealed in a study by researchers at Martin Luther ...
Jul 20, 2021
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2140
Engineering
A new algorithm developed at Imperial College London can convert 2D images of composite materials into 3D structures.
Apr 6, 2021
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372
Machine learning & AI
Conformer search continues to be a topic of great interest in computational chemistry, drug design and material science. It is a challenging endeavor due to the high dimensionality of the search space and the computational ...
Apr 1, 2021
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8
Machine learning & AI
Machine learning models can rapidly and accurately estimate key chemical parameters related to molecular reactivity.
Aug 25, 2020
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159
Energy & Green Tech
Thermoelectric materials convert heat to electricity or vice versa. However, their application to harvest waste heat is limited by challenges in fabrication and materials. Finding cost-effective ways to cover large and potentially ...
Apr 15, 2020
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129
Energy & Green Tech
Petrochemicals, the oil- and gas-derived compounds that serve as the molecular backbones for much of modern commerce, commanded a $539.3 billion market value in 2018.
Apr 30, 2019
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12
Energy & Green Tech
Scientists from the University of California, Los Angeles (UCLA) and Solargiga Energy in China have discovered that caffeine can help make a promising alternative to traditional solar cells more efficient at converting light ...
Apr 25, 2019
1
3742
A chemical structure includes molecular geometry, electronic structure and crystal structure of a chemical compound. Molecular geometry refers to the spatial arrangement of atoms in a molecule and the chemical bonds that hold the atoms together. Molecular geometry can range from the very simple, such as diatomic oxygen or nitrogen molecules, to the very complex, such as protein or DNA molecules. Molecular geometry can be roughly represented using a structural formula. Electronic structure describes the occupation of a compound's molecular orbitals.
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