Kanchana S. Thanthiriwatte, Ph.D. - Publications

2009 Chemistry Mississippi State University, Starkville, MS, United States 
Physical Chemistry

13 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2016 Fang Z, Thanthiriwatte KS, Dixon DA, Andrews L, Wang X. Properties of Cerium Hydroxides from Matrix Infrared Spectra and Electronic Structure Calculations. Inorganic Chemistry. PMID 26814626 DOI: 10.1021/acs.inorgchem.5b02619  1
2015 Vent-Schmidt T, Andrews L, Thanthiriwatte KS, Dixon DA, Riedel S. Reaction of Laser-Ablated Uranium and Thorium Atoms with H2Se: A Rare Example of Selenium Multiple Bonding. Inorganic Chemistry. 54: 9761-9. PMID 26418218 DOI: 10.1021/acs.inorgchem.5b01383  1
2015 Thanthiriwatte KS, Vasiliu M, Battey SR, Lu Q, Peterson KA, Andrews L, Dixon DA. Gas Phase Properties of MX2 and MX4 (X = F, Cl) for M = Group 4, Group 14, Cerium, and Thorium. The Journal of Physical Chemistry. A. 119: 5790-803. PMID 25942320 DOI: 10.1021/acs.jpca.5b02544  1
2014 Thanthiriwatte KS, Spruell JM, Dixon DA, Christe KO, Jenkins HD. Structures, vibrational frequencies, and stabilities of halogen cluster anions and cations, X(n)(+/-), n = 3, 4, and 5. Inorganic Chemistry. 53: 8136-46. PMID 25033167 DOI: 10.1021/ic501211f  1
2013 Wang X, Andrews L, Thanthiriwatte KS, Dixon DA. Infrared spectra of H2ThS and H2US in noble gas matrixes: enhanced H-An-S covalent bonding. Inorganic Chemistry. 52: 10275-85. PMID 24007281 DOI: 10.1021/ic400560k  1
2013 Andrews L, Thanthiriwatte KS, Wang X, Dixon DA. Thorium fluorides ThF, ThF2, ThF3, ThF4, ThF3(F2), and ThF5- characterized by infrared spectra in solid argon and electronic structure and vibrational frequency calculations. Inorganic Chemistry. 52: 8228-33. PMID 23805882 DOI: 10.1021/ic401107w  1
2012 Thanthiriwatte KS, Vasiliu M, Dixon DA, Christe KO. Structural and energetic properties of closed shell XF(n) (X = Cl, Br, and I; n = 1-7) and XO(n)F(m) (X = Cl, Br, and I; n = 1-3; m = 0-6) molecules and ions leading to stability predictions for yet unknown compounds. Inorganic Chemistry. 51: 10966-82. PMID 23009656 DOI: 10.1021/ic301438b  1
2012 Thanthiriwatte KS, Duke JR, Jackson VE, Felmy AR, Dixon DA. High-level ab initio predictions of the energetics of mCO2·(H2O)n (n = 1-3, m = 1-12) clusters. The Journal of Physical Chemistry. A. 116: 9718-29. PMID 22924553 DOI: 10.1021/jp306594h  1
2012 Gong Y, Andrews L, Bauschlicher CW, Thanthiriwatte KS, Dixon DA. Infrared spectroscopic and theoretical studies of the OTiF2, OZrF2 and OHfF2 molecules with terminal oxo ligands. Dalton Transactions (Cambridge, England : 2003). 41: 11706-15. PMID 22899544 DOI: 10.1039/c2dt31223a  1
2011 Thanthiriwatte KS, Hohenstein EG, Burns LA, Sherrill CD. Assessment of the performance of DFT and DFT-D methods for describing distance dependence of hydrogen-bonded interactions Journal of Chemical Theory and Computation. 7: 88-96. DOI: 10.1021/ct100469b  1
2009 Marshall MS, Steele RP, Thanthiriwatte KS, Sherrill CD. Potential energy curves for cation-pi interactions: off-axis configurations are also attractive. The Journal of Physical Chemistry. A. 113: 13628-32. PMID 19886621 DOI: 10.1021/jp906086x  1
2006 Thanthiriwatte KS, Gwaltney SR. Excitation spectra of dibenzoborole containing pi-electron systems: controlling the electronic spectra by changing the p(pi)-pi* conjugation. The Journal of Physical Chemistry. A. 110: 2434-9. PMID 16480302 DOI: 10.1021/jp0545492  1
2002 Thanthiriwatte KS, Nalin de Silva KM. Non-linear optical properties of novel fluorenyl derivatives - Ab initio quantum chemical calculations Journal of Molecular Structure: Theochem. 617: 169-175. DOI: 10.1016/S0166-1280(02)00419-0  1
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