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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-6-516

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Collection's Items (Sorted by Submit Date in Descending order): 2501 to 2520 of 5986
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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF93_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-1964.96300546; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF94_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-1964.96273168; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF97_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-1964.96285278; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF98_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-1964.96304772; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF128_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99311534; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF131_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99306926; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF132_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99206924; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF135_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99322570; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF136_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99372749; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF137_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99392925; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF190_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99420218; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF194_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99421148; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF195_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99419303; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF196_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99429707; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF199_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99415519; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF201_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99382947; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF202_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99439441; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF203_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99376726; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF207_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99522823; Eh
thumbnail.jpeg27-Mar-2025trifloxysulfuron-Na_CONF43_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-1964.99352740; Eh
Collection's Items (Sorted by Submit Date in Descending order): 2501 to 2520 of 5986
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