Alexandria Library
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The Alexandria library is as an open access quantum-chemical database <br> of molecular optimized geometries, frequencies, thermochemistry, polarizability and molecular electric moments<br> for organic and inorganic molecules. The name<br> Alexandria highlights that we aim to collect all<br> knowledge in the world, old and new, on molecular properties, just<br> like the legendary library of Alexandria, since availability of data rapidly declines with time.This library will assist systematic development and training of empirical <br> force fields for a broad range of molecules.
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Zenodo创建时间：
2017-10-08
