Browse Collection: Computational_PFAS_Data
Computational_PFAS_Data
https://iochem-bd.bsc.es/browse/handle/100/500769
2026-07-04T05:34:34Z
2026-07-04T05:34:34Z
/NTA/DFT_OptFreq Compound 11
Armentrout, Peter
Ieritano, Christian
Dodds, James
Hopkins, Scott
Baker, Erin
Fry, Allison
https://iochem-bd.bsc.es/browse/handle/100/500853
2026-07-03T15:59:09Z
2026-07-03T15:57:35Z
Title: /NTA/DFT_OptFreq Compound 11
Authors: Armentrout, Peter; Ieritano, Christian; Dodds, James; Hopkins, Scott; Baker, Erin; Fry, Allison
Abstract: DFT_OptFreq
2026-07-03T15:57:35Z
/PFP 8:8 PFPi
Armentrout, Peter
Ieritano, Christian
Dodds, James
Hopkins, Scott
Baker, Erin
Fry, Allison
https://iochem-bd.bsc.es/browse/handle/100/500849
2026-07-03T15:59:09Z
2026-07-03T15:57:36Z
Title: /PFP 8:8 PFPi
Authors: Armentrout, Peter; Ieritano, Christian; Dodds, James; Hopkins, Scott; Baker, Erin; Fry, Allison
Abstract: DFT_OptFreq_CCSDT
2026-07-03T15:57:36Z
/NTA/DFT_OptFreq Compound 8
Armentrout, Peter
Ieritano, Christian
Dodds, James
Hopkins, Scott
Baker, Erin
Fry, Allison
https://iochem-bd.bsc.es/browse/handle/100/500850
2026-07-03T15:59:09Z
2026-07-03T15:57:35Z
Title: /NTA/DFT_OptFreq Compound 8
Authors: Armentrout, Peter; Ieritano, Christian; Dodds, James; Hopkins, Scott; Baker, Erin; Fry, Allison
Abstract: DFT_OptFreq
2026-07-03T15:57:35Z
/NTA/DFT_OptFreq Compound 9
Armentrout, Peter
Ieritano, Christian
Dodds, James
Hopkins, Scott
Baker, Erin
Fry, Allison
https://iochem-bd.bsc.es/browse/handle/100/500851
2026-07-03T15:59:09Z
2026-07-03T15:57:35Z
Title: /NTA/DFT_OptFreq Compound 9
Authors: Armentrout, Peter; Ieritano, Christian; Dodds, James; Hopkins, Scott; Baker, Erin; Fry, Allison
Abstract: DFT_OptFreq
2026-07-03T15:57:35Z