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Author: karl irikura

Displaying records 41 to 50 of 53 records.
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41. Experimental and ab initio Study of the Infrared Spectra of Ionic Species Derived From PF5, PF3, and F3PO and Trapped in Solid Neon
Published: 5/1/1998
Authors: C Lugez, Marilyn E Jacox, Karl K Irikura
Abstract: When a Ne:PF^d5^ or a Ne:PF^d3^ is codeposited a 5 K with a beam of neon atoms that have been excited in a microwave discharge, the infrared spectrum of the resulting solid shows a complicated pattern of new absorptions. Little fragmentation of PF^d ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=841291

42. Computational Thermochemistry
Published: 2/1/1998
Author: Karl K Irikura
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=901956

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

44. 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

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

46. 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

47. 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

48. 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

49. 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

50. 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



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