Comparison between experimental and calculated IR spectra for the cis and trans compounds with significant intensities (cm-1).

Infrared band intensities: a comparative study of the transition moment matrix elements for the fundamental and overtones: Part II. Application to CO, HCl and OH

Singh, Surjit
Luck, Werner A. P.

May 1981

The various expressions considered in Part I for the transition moment matrix elements of fundamenta...

COMPARISON BETWEEN THEORIES OF IR ABSORP- TION IN HYDROGEN-BONDED COMPLEXES AND NEAR-IR AND VISIBLE ABSORPTION OF AN EXCESS

H. Abramczyk

January 1992

Infrared absorption in hydrogen-bonded complexes and absorption of an excess electron in hydrogen-bo...

Improved Infrared Spectra Prediction by DFT from a New Experimental Database

Katari, Madanakrishna
Nicol, Edith
Steinmetz, Vincent
Van der rest, Guillaume
Carmichael, Duncan
Frison, Gilles

June 2017

International audienceThis work aims to improve the computation of infrared spectra of gas-phase cat...

Comparison between calculated and experimental chemical shifts of the cis and trans isomers.

Seif Bennia (5988251)
Rim Milad (5988254)
Sabri Messaoudi (1585933)
Marine de Person (5988257)
Fathi Moussa (1777711)
Manef Abderrabba (1585927)
Denis Merlet (1772653)

November 2018

Comparison between calculated and experimental chemical shifts of the cis and trans isomers.</p

IR spectra of all hybrid systems obtained and pure SBA-15 mesoporous silica for comparison.

Dawid Lewandowski (734993)
Marta Lewandowska (734994)
Piotr Ruszkowski (734995)
Anita Pińska (734996)
Grzegorz Schroeder (623308)

May 2015

IR spectra of all hybrid systems obtained and pure SBA-15 mesoporous silica for comparison.</p

FT-IR spectra of the methylphenyl-silicone and modified methylphenyl-silicone at different temperature

B. Jiang (752763)
C. C. Zhu (752764)
Y. D. Huang (752765)

June 2015

FT-IR spectra of the methylphenyl-silicone and modified methylphenyl-silicone at different temper...

IR spectra of the free ligands (CMZ, MP and SCZ) compared to their (UO22+) complexes.

Abeer A. Sharfalddin (10652888)
Abdul-Hamid Emwas (1235382)
Mariusz Jaremko (363140)
Mostafa A. Hussien (9287436)

August 2021

IR spectra of the free ligands (CMZ, MP and SCZ) compared to their (UO22+) complexes.</p

Applications of group theory: infrared and raman spectra of the isomers of cis- and trans-1,2-dichloroethylene

Craig, Norman C.

A study of the vibrational spectra of {em cis}- and {em trans}-1,2-dichloroethylene provides an exce...

FT-IR absorption spectra for β-CD (red), RU (black) and RU-β-CD complex (blue).

Magdalena Paczkowska (715027)
Mikołaj Mizera (715028)
Hanna Piotrowska (715029)
Daria Szymanowska-Powałowska (715030)
Kornelia Lewandowska (715031)
Joanna Goscianska (715032)
Robert Pietrzak (715033)
Waldemar Bednarski (688868)
Zbigniew Majka (715034)
Judyta Cielecka-Piontek (715035)

March 2015

FT-IR absorption spectra for β-CD (red), RU (black) and RU-β-CD complex (blue).</p

IR spectra of the three NM types.

Mireille Engelen (122853)
Renzo Vanna (122856)
Chiara Bellei (122858)
Fabio A. Zucca (122860)
Kazumasa Wakamatsu (55669)
Enrico Monzani (122862)
Shosuke Ito (55670)
Luigi Casella (122865)
Luigi Zecca (122868)

November 2012

Comparison of IR spectra of SN-NM, other-NM (from PAL) and CAL-NM. Typical absorptions are indica...

Spectrum Comparison of IR Data Taken from Different Spectrometers with Various Precision

Kavak H.
Esen R.

January 1993

A group of algorithms and a computer program based on these algorithms are developed for comparing I...

FT-IR spectra of (a) WMS, (b) SNCH2SO4,3, (c) SNCH2SO4,7, and (d) SNCHCl,7.

Benxi Wei (528412)
Xueming Xu (528413)
Zhengyu Jin (528414)
Yaoqi Tian (528415)

February 2014

FT-IR spectra of (a) WMS, (b) SNCH2SO4,3, (c) SNCH2SO4,7, and (d) SNCH...

Quantum chemical intensity determinations of overlapped gas phase infrared bands

Duarte, L.J.
Richter, W.E.
Silva, A.F.
Bruns, R.E.

June 2020

The largest source of experimental error in determining gas phase fundamental infrared intensities a...

Consensus informational spectrum (CIS) of β2AR:IR tetramers with the characteristic peak at F(0.216).

Maja Mandić (662591)
Luka Drinovec (662592)
Sanja Glisic (168160)
Nevena Veljkovic (338669)
Jane Nøhr (662593)
Milka Vrecl (662594)

November 2014

(A) β2AR:β2AR:β2AR:IR, (B) β2AR:β2AR:IR:IR...

THE NORMAL CO-ORDINATE ANALYSES, VIBRATIONAL SPECTRA AND THEORETICAL INFRARED INTENSITIES

Of Some
Thiocarbonyl Halide Molecules

October 2015

TITLE: The normal co-ordinate analysis, vibrational spectra and theoretical infrared intensities of ...

Infrared band intensities: a comparative study of the transition moment matrix elements for the fundamental and overtones: Part II. Application to CO, HCl and OH

Singh, Surjit
Luck, Werner A. P.

May 1981

The various expressions considered in Part I for the transition moment matrix elements of fundamenta...

COMPARISON BETWEEN THEORIES OF IR ABSORP- TION IN HYDROGEN-BONDED COMPLEXES AND NEAR-IR AND VISIBLE ABSORPTION OF AN EXCESS

H. Abramczyk

January 1992

Infrared absorption in hydrogen-bonded complexes and absorption of an excess electron in hydrogen-bo...

Improved Infrared Spectra Prediction by DFT from a New Experimental Database

Katari, Madanakrishna
Nicol, Edith
Steinmetz, Vincent
Van der rest, Guillaume
Carmichael, Duncan
Frison, Gilles

June 2017

International audienceThis work aims to improve the computation of infrared spectra of gas-phase cat...

Comparison between calculated and experimental chemical shifts of the cis and trans isomers.

Seif Bennia (5988251)
Rim Milad (5988254)
Sabri Messaoudi (1585933)
Marine de Person (5988257)
Fathi Moussa (1777711)
Manef Abderrabba (1585927)
Denis Merlet (1772653)

November 2018

Comparison between calculated and experimental chemical shifts of the cis and trans isomers.</p

IR spectra of all hybrid systems obtained and pure SBA-15 mesoporous silica for comparison.

Dawid Lewandowski (734993)
Marta Lewandowska (734994)
Piotr Ruszkowski (734995)
Anita Pińska (734996)
Grzegorz Schroeder (623308)

May 2015

IR spectra of all hybrid systems obtained and pure SBA-15 mesoporous silica for comparison.</p

FT-IR spectra of the methylphenyl-silicone and modified methylphenyl-silicone at different temperature

B. Jiang (752763)
C. C. Zhu (752764)
Y. D. Huang (752765)

June 2015

FT-IR spectra of the methylphenyl-silicone and modified methylphenyl-silicone at different temper...

IR spectra of the free ligands (CMZ, MP and SCZ) compared to their (UO22+) complexes.

Abeer A. Sharfalddin (10652888)
Abdul-Hamid Emwas (1235382)
Mariusz Jaremko (363140)
Mostafa A. Hussien (9287436)

August 2021

IR spectra of the free ligands (CMZ, MP and SCZ) compared to their (UO22+) complexes.</p

Applications of group theory: infrared and raman spectra of the isomers of cis- and trans-1,2-dichloroethylene

Craig, Norman C.

A study of the vibrational spectra of {em cis}- and {em trans}-1,2-dichloroethylene provides an exce...

FT-IR absorption spectra for β-CD (red), RU (black) and RU-β-CD complex (blue).

Magdalena Paczkowska (715027)
Mikołaj Mizera (715028)
Hanna Piotrowska (715029)
Daria Szymanowska-Powałowska (715030)
Kornelia Lewandowska (715031)
Joanna Goscianska (715032)
Robert Pietrzak (715033)
Waldemar Bednarski (688868)
Zbigniew Majka (715034)
Judyta Cielecka-Piontek (715035)

March 2015

FT-IR absorption spectra for β-CD (red), RU (black) and RU-β-CD complex (blue).</p

IR spectra of the three NM types.

Mireille Engelen (122853)
Renzo Vanna (122856)
Chiara Bellei (122858)
Fabio A. Zucca (122860)
Kazumasa Wakamatsu (55669)
Enrico Monzani (122862)
Shosuke Ito (55670)
Luigi Casella (122865)
Luigi Zecca (122868)

November 2012

Comparison of IR spectra of SN-NM, other-NM (from PAL) and CAL-NM. Typical absorptions are indica...

Spectrum Comparison of IR Data Taken from Different Spectrometers with Various Precision

Kavak H.
Esen R.

January 1993

A group of algorithms and a computer program based on these algorithms are developed for comparing I...

FT-IR spectra of (a) WMS, (b) SNCH2SO4,3, (c) SNCH2SO4,7, and (d) SNCHCl,7.

Benxi Wei (528412)
Xueming Xu (528413)
Zhengyu Jin (528414)
Yaoqi Tian (528415)

February 2014

FT-IR spectra of (a) WMS, (b) SNCH2SO4,3, (c) SNCH2SO4,7, and (d) SNCH...

Quantum chemical intensity determinations of overlapped gas phase infrared bands

Duarte, L.J.
Richter, W.E.
Silva, A.F.
Bruns, R.E.

June 2020

The largest source of experimental error in determining gas phase fundamental infrared intensities a...

Consensus informational spectrum (CIS) of β2AR:IR tetramers with the characteristic peak at F(0.216).

Maja Mandić (662591)
Luka Drinovec (662592)
Sanja Glisic (168160)
Nevena Veljkovic (338669)
Jane Nøhr (662593)
Milka Vrecl (662594)

November 2014

(A) β2AR:β2AR:β2AR:IR, (B) β2AR:β2AR:IR:IR...

THE NORMAL CO-ORDINATE ANALYSES, VIBRATIONAL SPECTRA AND THEORETICAL INFRARED INTENSITIES

Of Some
Thiocarbonyl Halide Molecules

October 2015

TITLE: The normal co-ordinate analysis, vibrational spectra and theoretical infrared intensities of ...

Infrared band intensities: a comparative study of the transition moment matrix elements for the fundamental and overtones: Part II. Application to CO, HCl and OH

Singh, Surjit
Luck, Werner A. P.

May 1981

The various expressions considered in Part I for the transition moment matrix elements of fundamenta...

COMPARISON BETWEEN THEORIES OF IR ABSORP- TION IN HYDROGEN-BONDED COMPLEXES AND NEAR-IR AND VISIBLE ABSORPTION OF AN EXCESS

H. Abramczyk

January 1992

Infrared absorption in hydrogen-bonded complexes and absorption of an excess electron in hydrogen-bo...

Improved Infrared Spectra Prediction by DFT from a New Experimental Database

Katari, Madanakrishna
Nicol, Edith
Steinmetz, Vincent
Van der rest, Guillaume
Carmichael, Duncan
Frison, Gilles

June 2017

International audienceThis work aims to improve the computation of infrared spectra of gas-phase cat...

Comparison between experimental and calculated IR spectra for the <i>cis</i> and <i>trans</i> compounds with significant intensities (cm<sup>-1</sup>).

Abstract

Extracted data

Comparison between experimental and calculated IR spectra for the <i>cis</i> and <i>trans</i> compounds with significant intensities (cm<sup>-1</sup>).

Abstract

Extracted data

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