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It employs a discretization scheme based on functional approximations and a collocation technique to enforce the global flow solution.
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A recent development, based on functional approximation theory, has achieved a new functional form; namely, multi-layer functionals.
Classifications are based on functional mobility.
The computational methods by the application of first principle calculations based on density functional theory (DFT) with approximations such as local density approximation (LDA) and generalized gradient approximation (GGA) have been extensively applied in the field of Li+ batteries [26].
An approximated P-value is derived, based on Gaussian approximations [ 21] or Poisson approximations [ 22- 25].
The generalized gradient approximation based on density functional theory is used to study the effects of the benzyne group on the M3N@C80 (M = Sc, Y) clusters.
Based on these approximations, we derived the prior odds (Additional file 1A), i.e. the ratio of probability of functional association and its negation without evidence, and the posterior odds, i.e. the ratio of probability of functional association and its negation given the evidence, for each dataset (Additional file 1B) and subsequently determined the LLS.
In this work we present the structural, electronic, optical, and elastic properties of π-SnSe using ultrasoft pseudo-potential technique based on density functional theory with local density approximations (LDA) and generalized gradient approximations GGA).
Our current knowledge concerning the initial steps leading to CIN is largely based on experimental approximations.
The 95% confidence intervals (CI) of HPV prevalence were based on normal approximations.
Hydrogen adsorption and storage on calcium-decorated, boron-doped graphene was explored using density functional theory simulations based on local density approximation and generalized gradient approximation methods.
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