Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project.
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Postsynaptic VAMP/Synaptobrevin Facilitates Differential Vesicle Trafficking of GluA1 and GluA2 AMPA Receptor Subunits.Energy decomposition analysis based on a block-localized wavefunction and multistate density functional theoryThe crystal chemistry of inorganic metal borohydrides and their relation to metal oxides.Designing mixed metal halide ammines for ammonia storage using density functional theory and genetic algorithms.Novel sodium aluminium borohydride containing the complex anion [Al(BH4,Cl)4]-.Destabilization effect of transition metal fluorides on sodium borohydride.Van Der Waals heterogeneous layer-layer carbon nanostructures involving π···H-C-C-H···π···H-C-C-H stacking based on graphene and graphane sheets.Adjacent Lone Pair (ALP) Effect: A Computational Approach for Its Origin.Al3Li4(BH4)13: a complex double-cation borohydride with a new structure.A multifaceted approach to hydrogen storage.Recent Advances in the Use of Sodium Borohydride as a Solid State Hydrogen StoreFrom the computer to the laboratory: materials discovery and design using first-principles calculationsBinding in alkali and alkaline-earth tetrahydroborates: Special position of magnesium tetrahydroborateSimple descriptors for proton-conducting perovskites from density functional theoryCombined X-ray and Raman Studies on the Effect of Cobalt Additives on the Decomposition of Magnesium Borohydride
P2860
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P2860
Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project.
description
2009 nî lūn-bûn
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2009年の論文
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2009年学术文章
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name
Density functional theory base ...... ional material design project.
@en
Density functional theory base ...... ional material design project.
@nl
type
label
Density functional theory base ...... ional material design project.
@en
Density functional theory base ...... ional material design project.
@nl
prefLabel
Density functional theory base ...... ional material design project.
@en
Density functional theory base ...... ional material design project.
@nl
P2093
P2860
P50
P356
P1476
Density functional theory base ...... ional material design project.
@en
P2093
A Calborean
A DeLaRiva
A H Larsen
A Kelkkanen
A L Bezanilla
A L Schoenhalz
P2860
P304
P356
10.1063/1.3148892
P407
P50
P577
2009-07-01T00:00:00Z