Benchmarking Calculated Lattice Parameters and Energies of Molecular Crystals Using van der Waals Density Functionals.

scientific article published on August 2014

Benchmarking Calculated Lattice Parameters and Energies of Molecular Crystals Using van der Waals Density Functionals. is …
instance of (P31):
scholarly articleQ13442814

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P356DOI10.1021/CT500335B
P8608Fatcat IDrelease_c4zbjiphbvfifc44ulmv2g6aty
P698PubMed publication ID26588311

P50authorAndrew L RohlQ50754644
P2093author name stringDamien J Carter
P433issue8
P921main subjectcomputational benchmarkQ125963897
P304page(s)3423-3437
P577publication date2014-08-01
P1433published inJournal of Chemical Theory and ComputationQ1768377
P1476titleBenchmarking Calculated Lattice Parameters and Energies of Molecular Crystals Using van der Waals Density Functionals
P478volume10

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cites work (P2860)
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Q41671046Powder diffraction and crystal structure prediction identify four new coumarin polymorphs.
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