capture reactionDuan, Yuhua; Sorescu, Dan C. · Physical Review B · 2009

Assessing a Generalized CHNO Intermolecular Potential through ab Initio Crystal Structure PredictionRice, Betsy M.; Sorescu, Dan C. · 2004

Theoretical and experimental studies of the structure and vibrational spectra of NTODan C. Sorescu; Teressa R.L. Sutton; Donald L. Thompson; David Beardall; Charles A. Wight · 1996

Oxygen Atom Exchange between Gaseous CO <sub/>2</sub> and TiO <sub/>2</sub> NanoclustersCiviš, Svatopluk; Ferus, Martin; Zukalová, Markéta; Zukal, Arnošt; Kavan, Ladislav; Jordan, Kenneth D.; Sorescu, Dan C. · The Journal of Physical Chemistry C · 2015

Effects of an external electromagnetic field on rutile Tio2: A molecular dynamics studyNiall J. English; Dan C. Sorescu; J. Karl Johnson · 2006

Theoretical Investigation of Hydrogen Adsorption and Dissociation on Iron and Iron Carbide Surfaces Using the ReaxFF Reactive Force Field MethodZou, Chenyu; Duin, Adri C. T.; Sorescu, Dan C. · 2012

Adsorption and activation of CO coadsorbed with K on Fe(100) surface: A plane-wave DFT studyDan C. Sorescu · 2011