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Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project.
J Chem Phys. 2009 Jul 7;131(1):014101. doi: 10.1063/1.3148892.
J Chem Phys. 2009.
PMID: 19586090
Free article.
First principles investigation of zinc-anode dissolution in zinc-air batteries.
Siahrostami S, Tripković V, Lundgaard KT, Jensen KE, Hansen HA, Hummelshøj JS, Mýrdal JS, Vegge T, Nørskov JK, Rossmeisl J.
Siahrostami S, et al. Among authors: myrdal js.
Phys Chem Chem Phys. 2013 May 7;15(17):6416-21. doi: 10.1039/c3cp50349f.
Phys Chem Chem Phys. 2013.
PMID: 23525197
Free article.
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A DFT-based genetic algorithm search for AuCu nanoalloy electrocatalysts for CO₂ reduction.
Lysgaard S, Mýrdal JS, Hansen HA, Vegge T.
Lysgaard S, et al. Among authors: myrdal js.
Phys Chem Chem Phys. 2015 Nov 14;17(42):28270-6. doi: 10.1039/c5cp00298b. Epub 2015 Apr 30.
Phys Chem Chem Phys. 2015.
PMID: 25924775
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Communication: the influence of CO2 poisoning on overvoltages and discharge capacity in non-aqueous Li-Air batteries.
Mekonnen YS, Knudsen KB, Mýrdal JS, Younesi R, Højberg J, Hjelm J, Norby P, Vegge T.
Mekonnen YS, et al. Among authors: myrdal js.
J Chem Phys. 2014 Mar 28;140(12):121101. doi: 10.1063/1.4869212.
J Chem Phys. 2014.
PMID: 24697413
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