2013
CHAPTER 1
Konezny S, Batista V. CHAPTER 1. Energy And Environment Series 2013, 1-36. DOI: 10.1039/9781849735445-00001.Peer-Reviewed Original ResearchMolecular adsorbatesEarth abundant transition metal complexesTransition metal complexesInverse molecular designSolar cellsNew photocatalytic materialsSolar light absorptionMetal complexesRedox propertiesSolar cell componentsChemical fuelsMolecular designPhotocatalytic materialsSolar cell assemblyNanoporous materialsRedox potentialFirst-principles calculationsCharge transportCurrent-voltage characteristicsLight absorptionPrinciples calculationsSemiconductor materialsAdsorbatesFundamental insightsMechanistic characterization
2011
Energy Research: Computational Challenges
Batista V. Energy Research: Computational Challenges. 2011 DOI: 10.1002/9781119951438.eibc0461.Peer-Reviewed Original ResearchElectron transferEarth abundant transition metal complexesTransition metal complexesInterfacial electron transferNovel photocatalytic materialsVisible light absorptionNanoporous TiO2 thin filmsMetal complexesManganese catalystsPhotocatalytic materialsPhotocatalytic mechanismTiO2 thin filmsLight absorptionSolar cellsRecent computational workSemiconductor materialsFuel productionThin filmsRenewable resourcesElectrochemistryOverall efficiencyCatalystSpectroscopyComputational workRecent advances
2005
Energy Research: Computational Challenges
Batista V. Energy Research: Computational Challenges. 2005 DOI: 10.1002/0470862106.ia812.Peer-Reviewed Original ResearchElectron transferEarth abundant transition metal complexesTransition metal complexesInterfacial electron transferNovel photocatalytic materialsVisible light absorptionNanoporous TiO2 thin filmsMetal complexesManganese catalystsPhotocatalytic materialsPhotocatalytic mechanismTiO2 thin filmsLight absorptionSolar cellsRecent computational workSemiconductor materialsFuel productionThin filmsRenewable resourcesElectrochemistryOverall efficiencyCatalystSpectroscopyComputational workRecent advances