Browse by Basel Contributors ID
2022San Vicente Veliz, Juan Carlos. Small molecules atomistic simulations: from QCT to machine learned models. 2022, Doctoral Thesis, University of Basel, Faculty of Science. 2021Veliz, Juan Carlos San Vicente and Koner, Debasish and Schwilk, Max and Bemish, Raymond J. and Meuwly, Markus. (2021) The C(P-3) + O-2((3)sigma(-)(g)) -> CO2 CO((1)sigma(+)) + O(D-1)/O(P-3) reaction: thermal and vibrational relaxation rates from 15 K to 20 000 K. Physical Chemistry Chemical Physics, 23 (19). pp. 11251-11263. 2020San Vicente Veliz, Juan Carlos and Koner, Debasish and Schwilk, Max and Bemish, Raymond J. and Meuwly, Markus. (2020) The N(4S) + O2(X3Sigma) O(3P) + NO(X2Pi) reaction: thermal and vibrational relaxation rates for the 2A', 4A' and 2A'' states. Physical Chemistry Chemical Physics, 22 (7). pp. 3927-3939. Koner, Debasish and San Vicente Veliz, Juan Carlos and Bemish, Raymond J. and Meuwly, Markus. (2020) Accurate reproducing kernel-based potential energy surfaces for the triplet ground states of N; 2; O and dynamics for the N + NO ↔ O + N; 2; and N; 2; + O → 2N + O reactions. Physical Chemistry Chemical Physics, 22 (33). pp. 18257-18260. 2019Koner, Debasish and San Vicente Veliz, Juan Carlos and van der Avoird, Ad and Meuwly, Markus. (2019) Near dissociation states for H2+-He on MRCI and FCI potential energy surfaces. Physical Chemistry Chemical Physics, 21 (45). pp. 24976-24983. |
