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Stabilizing the dopability of chalcogens in BaZrO3 through TiZr co-doping and its impact on the opto-electronic and photocatalytic properties: A meta-GGA level DFT study

Zulfiqar, Waqas (author)
Computational Materials Modeling Laboratory, Department of Physics, Government College University, Faisalabad, 38040, Faisalabad, Pakistan
Javed, Farrukh (author)
Computational Materials Modeling Laboratory, Department of Physics, Government College University, Faisalabad, 38040, Faisalabad, Pakistan; Department of Chemical Engineering, McGill University, 845 Sherbrooke St. W, Montreal, Quebec, Canada
Abbas, Ghulam (author)
Luleå tekniska universitet,Materialvetenskap
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Larsson, J. Andreas (author)
Luleå tekniska universitet,Materialvetenskap
Alay-e-Abbas, Syed Muhammad (author)
Luleå tekniska universitet,Materialvetenskap,Computational Materials Modeling Laboratory, Department of Physics, Government College University, Faisalabad, 38040, Faisalabad, Pakistan
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Computational Materials Modeling Laboratory, Department of Physics, Government College University, Faisalabad, 38040, Faisalabad, Pakistan Computational Materials Modeling Laboratory, Department of Physics, Government College University, Faisalabad, 38040, Faisalabad, Pakistan; Department of Chemical Engineering, McGill University, 845 Sherbrooke St W, Montreal, Quebec, Canada (creator_code:org_t)
Elsevier, 2024
2024
English.
In: International journal of hydrogen energy. - : Elsevier. - 0360-3199 .- 1879-3487. ; 58, s. 409-415
  • Journal article (peer-reviewed)
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Subject headings

NATURVETENSKAP  -- Fysik -- Den kondenserade materiens fysik (hsv//swe)
NATURAL SCIENCES  -- Physical Sciences -- Condensed Matter Physics (hsv//eng)
NATURVETENSKAP  -- Kemi -- Teoretisk kemi (hsv//swe)
NATURAL SCIENCES  -- Chemical Sciences -- Theoretical Chemistry (hsv//eng)

Keyword

Applied Physics
Tillämpad fysik

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