共 50 条
- [31] PHYS 393-Computation of potential energy surface and fitting of vibrational energy levels for HCFABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2008, 236Jordan, Christopher D.Polik, William F.
- [32] Quantum and classical study of vibrational states of H2+ and H3+ moleculesINTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2003, 95 (02) : 149 - 152Silva, WBCorrêa, EDAcioli, PHGargano, R
- [33] Reaction Dynamics of H3+ + CO on an Interpolated Potential Energy SurfaceJOURNAL OF PHYSICAL CHEMISTRY A, 2010, 114 (40): : 10783 - 10788Le, Hai-AnhFrankcombe, Terry J.Collins, Michael A.
- [34] Rovibrational energy levels of H3+ with energies above the barrier to linearityJOURNAL OF CHEMICAL PHYSICS, 2009, 131 (02):Bachorz, Rafal A.Cencek, WojciechJaquet, RalphKomasa, Jacek
- [35] Permutation invariant polynomial neural network approach to fitting potential energy surfacesJOURNAL OF CHEMICAL PHYSICS, 2013, 139 (05):Jiang, BinGuo, Hua
- [36] A systematic investigation of the ground state potential energy surface of H3+JOURNAL OF CHEMICAL PHYSICS, 2012, 136 (15):Jaquet, RalphKhoma, Mykhaylo V.
- [37] Potential energy surfaces and dynamics for the reactions between C(3P) and H3+(1A prime 1)Journal of Chemical Physics, 1998, 108 (06):Bettens, Ryan P.A.Collins, Michael A.
- [38] Neural networks vs Gaussian process regression for representing potential energy surfaces: A comparative study of fit quality and vibrational spectrum accuracyJOURNAL OF CHEMICAL PHYSICS, 2018, 148 (24):Kamath, AdityaVargas-Hernandez, Rodrigo A.Krems, Roman V.Carrington, Tucker, Jr.Manzhos, Sergei
- [39] Pairwise interactions for potential energy surfaces and atomic forces using deep neural networksCOMPUTATIONAL MATERIALS SCIENCE, 2022, 209Van-Quyen NguyenViet-Cuong NguyenTien-Cuong NguyenNguyen-Xuan-Vu NguyenTien-Lam Pham
- [40] Permutation invariant potential energy surfaces for polyatomic reactions using atomistic neural networksJOURNAL OF CHEMICAL PHYSICS, 2016, 144 (22):Kolb, BrianZhao, BinLi, JunJiang, BinGuo, Hua
