2 research outputs found
Studies on Molecular Structure and Vibrational Spectra of NLO Crystal L-Glutamine Oxalate by DFT Method
- Author
- Amalanathan M Hubert Joe I and Prabhu SS.
- Becke AD.
- Becke AD.
- Bellamy LJ.
- Colthup NB Daly LH, Willely SE.
- Ding YJ Mu X, Gu X.
- Dollish FR Fateley WG, Bentley FF.
- Dollish FR Fateley WG, Bentley FF.
- Glendening ED Reed AE, Carpenter JE, Weinhold F.
- Glendening ED Reed AE, Carpenter JE, Weinhold F.
- Hanumantharao R Kalainathan S.
- Jesintha John C Xavier TS, Amalanathan M, Hubert Joe I, Rastogi VK.
- John Clarkson Ewen Smith W.
- Kurtz SK Perry TT.
- Layne E.
- Lee C Yang W, Parr RG.
- Lin-Vien D Colthup NB, Fateley WG, Grasellim JG.
- Maroulis G.
- Mary MB Umadevi M, Pandiarajan S, Ramakrishnan V.
- Mulliken RS.
- Pawlukojc A Ho³derna-Natkaniec K, Bator G, Natkaniec I.
- Pulay P Fogarasi G, Pang F, Boggs JE.
- Qiushuo Yu Xiaoxun Ma, Long Xu.
- Rauhut G Pulay P.
- Ravikumar C Hubert Joe I, Jayakumar VS.
- Reed AE Curtiss LA, Weinhold F.
- Silverstin RM Webster FX.
- Smith BC.
- Snehalatha M Ravikumar C, Sekar N, Jayakumar VS and Hubert Joe I.
- Socrates G.
- Socrates G.
- Stoscheck CM.
- Sundius T.
- Sundius T.
- Wang XQ Xu D, Lu MK, Yuan DR, Xu SX.
- Publication venue
- 'Indian Society for Education and Environment'
- Publication date
- Field of study
Hydrogen bonds and ionic interactions in Guanidine/Guanidinium complexes: a computational case study
- Author
- A Bondi
- A Schaefer
- AD McNaught
- AE Reed
- AH Pakiari
- D Braga
- D Braga
- D Braga
- DE Woon
- E Espinosa
- F Weinhold
- FW Bieger-Konig
- G Gilli
- I Alkorta
- I Alkorta
- I Alkorta
- I Alkorta
- I Mayer
- I Rozas
- I Rozas
- I Rozas
- I Rozas
- I Rozas
- Ibon Alkorta
- Isabel Rozas
- JA Montgomery Jr
- JB Levy
- José Elguero
- JT Koskinen
- KB Wiberg
- L Brammer
- LA Curtiss
- M Head-Gordon
- M Meot-Ner
- MJ Frisch
- MJ Frisch
- MJ Frisch
- O Félix
- P Ayotte
- P Botschwina
- P Gilli
- P Gilli
- P Gilli
- P Gilli
- PC Hariharan
- PC Hariharan
- R Krishnan
- RFW Bader
- S Kim
- S Kim
- SB Boys
- SO Lee
- SU Son
- TH Dunning Jr
- V Ferretti
- VA Russell
- Y Chen
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study