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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg17-Jul-2025/Pt4-C3N4 Pt4-C3N4-C3H8-C1Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--549.24785985; eV
thumbnail.jpeg17-Jul-2025/Pt3 Pt3-C3H8-TS1-C2Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexImproved Dimer MethodDFT--66.65278573; eV
thumbnail.jpeg17-Jul-2025/Pt4-C3N4 Pt4-C3N4-C3H8-C2Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--549.24289301; eV
thumbnail.jpeg17-Jul-2025/Pt3 Pt3-C3H8-TS1-C1Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexImproved Dimer MethodDFT--66.64102270; eV
thumbnail.jpeg17-Jul-2025/Pt3 Pt3-C3H8-C1Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--66.71769906; eV
thumbnail.jpeg17-Jul-2025/Pt3 Pt3-C3H8-C2Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--66.73554029; eV
thumbnail.jpeg17-Jul-2025/Pt4-C3N4 Pt4-C3N4Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--491.83486168; eV
thumbnail.jpeg17-Jul-2025/Pt4-C3N4 Pt4-C3N4-C3H8-TS1-C1Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexImproved Dimer MethodDFT--548.89196616; eV
thumbnail.jpeg17-Jul-2025/Pt4-C3N4 Pt4-C3N4-C3H8-TS1-C2Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--549.10705884; eV
thumbnail.jpeg17-Jul-2025/Pt4-C3N4 Pt4-C3N4-CH2CH2CH3-C1Pan, Jievasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--549.10705884; eV
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