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- [11] Ab initio study for the intermolecular potential of the water-nitric oxide complexCHEMICAL PHYSICS LETTERS, 2000, 318 (1-3) : 232 - 239Myszkiewicz, GSadlej, J
- [12] Ab initio three-body interactions for water.: I.: Potential and structure of water trimerJOURNAL OF CHEMICAL PHYSICS, 2003, 118 (10): : 4386 - 4403Mas, EMBukowski, RSzalewicz, K
- [13] THE ONSET OF ION SOLVATION BY ab initio CALCULATIONS: COMPARISON OF WATER AND METHANOLCOLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS, 2008, 73 (6-7) : 733 - 744Pluharova, EvaJungwirth, Pavel
- [14] Full-dimensional ab initio potential energy surface and quantum calculations of water dimer.ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 228 : U271 - U271Jin, ZHuang, XCBraams, BJCarter, SBowman, JM
- [15] HEURISTIC INTERMOLECULAR POTENTIAL FUNCTION FOR FORMALDEHYDE-WATER BASED ON AB-INITIO MOLECULAR-ORBITAL CALCULATIONSJOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (24) : 7817 - 7822SWAMINATHAN, SWHITEHEAD, RJGUTH, EBEVERIDGE, DL
- [16] AB-INITIO CALCULATIONS ON THE GEOMETRY AND OH VIBRATIONAL FREQUENCY-SHIFT OF CYCLIC WATER TRIMERCHEMICAL PHYSICS, 1993, 175 (2-3) : 271 - 281VANDUIJNEVELDTVANDERIJDT, JGCMVANDUIJNEVELDT, FB
- [17] Ab initio calculations of polyhedra liquid waterFOOD CHEMISTRY, 2003, 82 (01) : 23 - 28Dauchez, MPeticolas, WLDebelle, LAlix, AJP
- [18] Ab initio calculations on phenol-waterCHEMICAL PHYSICS LETTERS, 2001, 350 (5-6) : 565 - 572Tsui, HHYvan Mourik, T
- [19] Ab initio calculations on uracil-waterJOURNAL OF PHYSICAL CHEMISTRY A, 1999, 103 (11): : 1611 - 1618van Mourik, TPrice, SLClary, DC
- [20] The structure of dilute clusters of methane and water by ab initio quantum mechanical calculationsJOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107 (13): : 2289 - 2295Ruckenstein, EShulgin, ILTilson, JL
