TY  - RPRT
TI  - Zero-Field NMR and Millitesla-SLIC Spectra for >200 Molecules from Density Functional Theory and Spin Dynamics
AU  - Mandzhieva, Iuliia [North Carolina State University, Raleigh, NC (United States)] (ORCID:0000000191549012)
AU  - Theiss, Franziska [North Carolina State University, Raleigh, NC (United States)] (ORCID:0009000232738950)
AU  - He, Xingtao [Duke Univ., Durham, NC (United States)] (ORCID:0009000478555353)
AU  - Ortmeier, Adam [North Carolina State University, Raleigh, NC (United States)]
AU  - Koirala, Anuja [North Carolina State University, Raleigh, NC (United States)]
AU  - McBride, Stephen J. [North Carolina State University, Raleigh, NC (United States)]
AU  - DeVience, Stephen J. [Univ. of Maryland, College Park, MD (United States)]
AU  - Rosen, Matthew S. [Massachusetts General Hospital, Boston, MA (United States)]
AU  - Blum, Volker [Duke Univ., Durham, NC (United States)] (ORCID:0000000186607230)
AU  - Theis, Thomas [North Carolina State University, Raleigh, NC (United States)] (ORCID:0000000167799978)
PY  - 2025
DO  - 10.1021/acs.jcim.5c00111
UR  - https://www.osti.gov/biblio/2865064
ID  - 2865064
ER  -