Chemistry Reference
In-Depth Information
.107.. Kendall.RA,.Apra.E,.Bernholdt.DE,.Bylaska.EJ,.Dupuis.M,.Fann.GI,.Harrison.RJ.et.
al.,.High.performance.computational.chemistry:.An.overview.of.NWChem.a.distributed.
parallel.application..
Computer Physics Communications
.2000;128(1-2):260-283.
.108.. Paolo.G,.Stefano.B,.Nicola.B,.Matteo.C,.Roberto.C,.Carlo.C,.Davide.C.et.al..QUANTUM.
ESPRESSO:.A.modular.and.open-source.software.project.for.quantum.simulations.of.
materials..
Journal of Physics: Condensed Matter
.2009(39):395502.
.109.. Kresse.G,.Hafner.J..Ab.initio.molecular.dynamics.for.liquid.metals..
Physical Review B
.
1993;47:558.
.110.. Kresse. G,. Furthmüller. J.. Eficiency. of. ab-initio. total. energy. calculations. for. metals.
and. semiconductors. using. a. plane-wave. basis. set..
Computational Materials Science
..
1996;6:15.
.111.. Yin.S,.Ellis.DE..DFT.studies.of.Cr(VI).complex.adsorption.on.hydroxylated.hematite.
(1-102).surfaces..
Surface Science
.2009;603(4):736-746.
.112.. Bargar. JR,. Towle. SN,. Brown. GE,. Parks. GA.. Outer-sphere. Pb(II). adsorbed. at. spe-
ciic. surface. sites. on. single. crystal. α-alumina..
Geochimica et Cosmochimica Acta
.
1996;60(18):3541-3547.
.113.. Bargar. JR,. Trainor. TP,. Fitts. JP,. Chambers. SA,. Brown. GE.. In. situ. grazing-incidence.
extended. X-ray. absorption. ine. structure. study. of. Pb(II). chemisorption. on. hematite.
(0001).and.(1-102).surfaces..
Langmuir
.2004;20(5):1667-1673.
.114.. Kendelewicz. T,. Liu. P,. Doyle. CS,. Brown. GE,. Jr.,. Nelson. EJ,. Chambers. SA.. X-ray.
absorption.and.photoemission.study.of.the.adsorption.of.aqueous.Cr(VI).on.single.crys-
tal.hematite.and.magnetite.surfaces..
Surface Science
.1999;424(2-3):219-231.
.115.. Gratzel.M..Photoelectrochemical.cells..
Nature
.2001;414(6861):338-344.
.116.. Green. MA..
Third Generation Photovoltaics: Advanced Solar Energy Conversion
..
Berlin:.Springer;.2003..xi,.160.p.
.117.. Conibeer.G..Third-generation.photovoltaics..
Materials Today
.2007;10(11):42-50.
.118.. Kamat. PV.. Meeting. the. clean. energy. demand:. nanostructure. architectures. for. solar.
energy.conversion..
The Journal of Physical Chemistry C
.2007;111(7):2834-2860.
.119.. Diebold. U.. The. surface. science. of. titanium. dioxide..
Surface Science Reports
.
2003;48(5-8):53-229.
.120.. Ihara. T,. Miyoshi. M,.Ando. M,. Sugihara. S,. Iriyama.Y.. Preparation. of. a. visible-light-
active. TiO
2
. photocatalyst. by. RF. plasma. treatment..
Journal of Materials Science
.
2001;36(17):4201-4207.
.121.. Park.JH,.Kim.S,.Bard.AJ..Novel.carbon-doped.TiO
2
.nanotube.arrays.with.high.aspect.
ratios.for.eficient.solar.water.splitting..
Nano Letters
.2006;6(1):24-28.
.122.. Ingler.WB,.Al-Shahr.M,.Kahn.SUM..Eficient.photochemical.water.splitting.by.a.chem-
ically.modiied.n-TiO
2
..
Science
.2002;297:2243-2245.
.123.. Di.Valentin. C,. Pacchioni. G,. Selloni.A..Theory. of. carbon. doping. of. titanium. dioxide..
Chemistry of Materials
.2005;17(26):6656-6665.
.124.. Di.Valentin.C,.Pacchioni.G,.Selloni.A..Origin.of.the.different.photoactivity.of.N-doped.
anatase.and.rutile.TiO
2
..
Physical Review B
.2004;70(8):.085116.
.125.. Asahi.R,.Morikawa.T,.Ohwaki.T,.Aoki.K,.Taga.Y..Visible-light.photocatalysis.in.nitro-
gen-doped.titanium.oxides..
Science
.2001;293(5528):269-271.
.126.. Di.Valentin.C,.Finazzi.E,.Pacchioni.G,.Selloni.A,.Livraghi.S,.Paganini.MC,.Giamello.E..
N-doped.TiO
2
:.Theory.and.experiment..
Chemical Physics
.2007;339(1-3):44-56.
.127.. Rane.KS,.Mhalsiker.R,.Yin.S,.Sato.T,.Cho.K,.Dunbar.E,.Biswas.P..Visible.light-sensitive.
yellow.TiO2-xNx.and.Fe-N.co-doped.Ti1-yFeyO2-xNx.anatase.photocatalysts..
Journal
of Solid State Chemistry
.2006;179(10):3033-3044.
.128.. Ghicov. A,. Macak. JM,. Tsuchiya. H,. Kunze. J,. Haeublein. V,. Frey. L,. Schmuki. P.. Ion.
implantation.and.annealing.for.an.eficient.N-doping.of.TiO
2
.nanotubes..
Nano Letters
.
2006;6(5):1080-1082.
Search WWH ::
Custom Search