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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Jul-20234_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--1367.59503661; Eh
thumbnail.jpeg24-Jul-2023butene_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--156.87939404; Eh
thumbnail.jpeg24-Jul-2023Me3Si+_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--408.44515890; Eh
thumbnail.jpeg24-Jul-20234_H-_at_phos_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--1368.26944701; Eh
thumbnail.jpeg24-Jul-20234_H-_at_phos_gas_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--1368.20425154; Eh
thumbnail.jpeg24-Jul-2023PBu3_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--813.52384787; Eh
thumbnail.jpeg24-Jul-20234_H-_at_carbon_gas_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--1368.27119171; Eh
thumbnail.jpeg24-Jul-20234_deprot_DHP-pos4_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--1367.11068763; Eh
thumbnail.jpeg24-Jul-2023Me3SiF_mecn_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--508.38540334; Eh
thumbnail.jpeg24-Jul-2023Me3SiH_gas_optMulks, FlorianOrca; 5.0.3; RELEASEGeometry optimizationDFT--409.24633254; Eh
Results 11-20 of 28 (Search time: 0.001 seconds).