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Author: karl irikura

Displaying records 41 to 50 of 52 records.
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41. Computational Thermochemistry
Published: 2/1/1998
Author: Karl K Irikura
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=901956

42. Essential Statistical Thermodynamics
Published: 2/1/1998
Author: Karl K Irikura
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=901954

43. Glossary of Common Terms and Abbreviations in Quantum Chemistry
Published: 2/1/1998
Author: Karl K Irikura
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=901952

44. Worked Examples
Published: 2/1/1998
Author: Karl K Irikura
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=901955

45. Ab Initio Ionization and Excitation Spectra Involving IO X^u2^II and IO^u+^ (X^u3^{Sigma}, a^u1^{Delta}b^1^(Sigma)^u+^)
Published: 12/1/1997
Authors: P Laszlo Hassanzadeh, Karl K Irikura, R D Johnson iii
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=100428

46. Electronic Structure of the BF2 Radical Determined by ab initio Calculations and Resonance Enhanced Multiphoton Ionization Spectroscopy
Published: 12/1/1997
Authors: D B Atkinson, Karl K Irikura, Jeffrey W Hudgens
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=100395

47. Nearly ab Initio Thermochemistry: The Use of Reaction Schemes. Application to IO and HOI
Published: 12/1/1997
Authors: P Laszlo Hassanzadeh, Karl K Irikura
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=100427

48. Rotational and Vibrational Spectroscopy and Ideal Gas Heat Capacity of HFC 134a (CF3CFH2)
Published: 12/1/1997
Authors: L H Xu, A M Andrews, Richard R Cavanagh, G T Fraser, Karl K Irikura, F J Lovas, J U Grabow, W Stahl, M K Crawford, R J Smalley
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=100385

49. Summary Report: Symposium on Computational Thermochemistry, Computers in Chemistry Division, American Chemical Society 212th National Meeting, Orlando, FL
Series: NIST Interagency/Internal Report (NISTIR)
Report Number: 5973
Published: 12/1/1997
Authors: Karl K Irikura, David Frurip
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=100433

50. Comment on The Reaction HCl+ + CF4 HCF4+ + Cl: Implications for the Heat of Formation of CF3+ (Ferguson et al., JCP 118, 2130, 2003)
Published: Date unknown
Author: Karl K Irikura
Abstract: Prompted by the suggestion that entropy is important in gas-phase ion-molecule reactions, Ferguson et al. recently re-examined the reaction between HCl+ and CF4 (Ferguson et al., JCP 118, 2130, 2003). Both the rate of the reaction and the products f ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=831912