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We find the metastable β -D019 phases are energetically competitive with the stable Mg-rich phases for all RE elements.
We used ab initio evolutionary algorithm to predict the stable and energetically competitive metastable structures of the nonlinear optical materials BiInS3 crystal.
The binding and formation energy calculations demonstrated that the proposed TM-DSTW-N4 defects are stable and energetically competitive with other types of defects.
The use of extracellular electron shuttles makes the Geobacter species circumvent the metabolic cost of producing the electron shuttles and consequently more energetically competitive than shuttle-producing Fe III) reducers in sub-surface environments [159].
The most energetically competitive computed structure found in the computational search is more distinct from the experimental AH packing.
Having energetically competitive modes of combining 2D sheets has accounted for polymorphism and/or stacking disorder in aspirin, phloroglucinol dihydrate, or modafinil and may account for the occurrence of concomitant polymorphism (e.g., aprepitant and progesterone).
Similar(49)
In particular, cis conformers become energetically more competitive and are topologically closer to the global minima.
Our new approach can successfully identify many hitherto unknown GSs and energetically highly competitive metastable structures.
But what this energetically anguished Helena has is a competitive will that is stronger than shame.
Fish exposed to SWCNTs retained competitive fitness when compelled to compete in energetically costly aggressive interactions with fish from both control groups.
Increasing call duration and intensity is energetically expensive [31], [33] [35] and has been hypothesized to indicate competitive ability and/or physiological condition of male frogs [36], [37].
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Justyna Jupowicz-Kozak
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