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Showing results 41 to 60 of 298 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_234Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.62647390; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_235Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.89430430; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_236Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.76525985; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_245Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.84693452; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_246Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.63834737; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_256Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.85487599; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_266Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.75779805; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_334Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.58033092; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_335Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.80626363; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_336Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.73891498; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_345Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.83718916; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_346Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.58732054; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_356Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.86982775; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_366Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.71887958; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_456Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.86664850; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_466Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.47080742; eV
thumbnail.jpeg23-Oct-20234f_core,_3_te,_label_566Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jan 29 2021 16:10:49) gamma-onlyGeometry optimizationDFT--698.87110623; eV
thumbnail.jpeg23-Oct-20234f_valence,_1_te,_label_4Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-onlyGeometry optimizationDFT--701.14461262; eV
thumbnail.jpeg23-Oct-20234f_valence,_1_te,_label_5Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jul 03 2015 11:45:30) gamma-onlyGeometry optimizationDFT--701.24502744; eV
thumbnail.jpeg23-Oct-20234f_valence,_1_te,_label_6Bruix, Albertvasp; 5.4.1; 24Jun15 (build Jul 03 2015 11:45:30) gamma-onlyGeometry optimizationDFT--701.15963474; eV
Showing results 41 to 60 of 298 < previous   next >