title: Absolute Intensities of NH-Stretching Transitions in Dimethylamine and Pyrrole

authors: Miller, Benjamin J.

subjects: chemistry

abstract: Vibrational spectra of vapor-phase dimethylamine (DMA) and pyrrole have been recorded in the 1000 to 13000 cm–1 region using long path conventional spectroscopy techniques. We have focused on the absolute intensities of the NH-stretching fundamental and overtone transitions; ΔνNH = 1–4 regions for DMA and the ΔνNH = 1–3 regions for pyrrole. In the ΔνNH = 1–3 regions for DMA, evidence of tunneling splitting associated with the NH-wagging mode is observed. For DMA, the fundamental NH-stretching transition intensity is weaker than the first NH-stretching overtone. Also, the fundamental NH-stretching transition in DMA is much weaker than the fundamental transition in pyrrole. We have used an anharmonic oscillator local mode model with ab initio calculated local mode parameters and dipole moment functions at the CCSD(T)/aug-cc-pVTZ level to calculate the NH-stretching intensities and explain this intensity anomaly in DMA.

text: Absolute Intensities of NH-Stretching Transitions in Dimethylamine and Pyrrole Vibrational spectra of vapor-phase dimethylamine (DMA) and pyrrole have been recorded in the 1000 to 13000 cm–1 region using long path conventional spectroscopy techniques. We have focused on the absolute intensities of the NH-stretching fundamental and overtone transitions; ΔνNH = 1–4 regions for DMA and the ΔνNH = 1–3 regions for pyrrole. In the ΔνNH = 1–3 regions for DMA, evidence of tunneling splitting associated with the NH-wagging mode is observed. For DMA, the fundamental NH-stretching transition intensity is weaker than the first NH-stretching overtone. Also, the fundamental NH-stretching transition in DMA is much weaker than the fundamental transition in pyrrole. We have used an anharmonic oscillator local mode model with ab initio calculated local mode parameters and dipole moment functions at the CCSD(T)/aug-cc-pVTZ level to calculate the NH-stretching intensities and explain this intensity anomaly in DMA.

year: 2012

title: A data mining approach to evaluate suitability of dissolved oxygen sensor observations for lake metabolism analysis

authors: Muraoka, Kohji

subjects: computer science

abstract: Despite rapid growth in continuous monitoring of dissolved oxygen for lake metabolism studies, the current best practice still relies on visual assessment and manual data filtering of sensor observations by experienced scientists in order to achieve meaningful results. This time consuming approach is fraught with potential for inconsistency and individual subjectivity. An automated method to assure the quality of data for the purpose of metabolism modeling is clearly needed to obtain consistent results representative of collective expertise. We used a hybrid approach of expert panel and data mining for data filtration. Symbolic Aggregate approXimation (SAX) treats discretized numerical timeseries segments as symbolic indications, creating a series of strings which are literally comparable to human words and sentences. This conversion allows established text mining techniques, such as classification methods to be applied to timeseries data. Half‐hourly frequency surface dissolved oxygen data from 18 global lakes were used to create day‐long segments of the original time series data. Three hundred sets of 1‐d measurements were provided to a group of seven anonymous experts, experienced in manual filtering of oxygen data for metabolism modeling studies. The collective results were treated as expert panel decisions, and were used to rank the data by confidence level for use in metabolism calculations. While considerable variation occurred in the way the experts perceived the quality of the data, the model provides an objective and quantitative assessment method. The program output will assist the decision making process in determining whether data should be used for metabolism calculations. An R version of the program is available for download.

text: A data mining approach to evaluate suitability of dissolved oxygen sensor observations for lake metabolism analysis Despite rapid growth in continuous monitoring of dissolved oxygen for lake metabolism studies, the current best practice still relies on visual assessment and manual data filtering of sensor observations by experienced scientists in order to achieve meaningful results. This time consuming approach is fraught with potential for inconsistency and individual subjectivity. An automated method to assure the quality of data for the purpose of metabolism modeling is clearly needed to obtain consistent results representative of collective expertise. We used a hybrid approach of expert panel and data mining for data filtration. Symbolic Aggregate approXimation (SAX) treats discretized numerical timeseries segments as symbolic indications, creating a series of strings which are literally comparable to human words and sentences. This conversion allows established text mining techniques, such as classification methods to be applied to timeseries data. Half‐hourly frequency surface dissolved oxygen data from 18 global lakes were used to create day‐long segments of the original time series data. Three hundred sets of 1‐d measurements were provided to a group of seven anonymous experts, experienced in manual filtering of oxygen data for metabolism modeling studies. The collective results were treated as expert panel decisions, and were used to rank the data by confidence level for use in metabolism calculations. While considerable variation occurred in the way the experts perceived the quality of the data, the model provides an objective and quantitative assessment method. The program output will assist the decision making process in determining whether data should be used for metabolism calculations. An R version of the program is available for download.

year: 2018

title: Different coloured tears: Dual cultural identity and Tangihanga

authors: Edge, Kiri

subjects: bereavement

abstract: Although whānau/family that are configured by both Pākehā and Māori identities number significantly within New Zealand, there has been little or no attention paid to the ways in which these identities influence the bereavement processes that will inevitably impact upon the lives of these whānau/family. The present study explored the experiences of an individual, whose whānau/family included two life ways: Māori and Pākehā. Of specific focus was the ways in which these identities influenced his bereavement subsequent to the death of his beloved wife, who was of Māori descent. One elderly male Pākehā participant was interviewed, using an open ended narrative approach. The interview was semi-structured around five broad themes, but the focus was upon the participant’s experiences and his preference in expressing these. The data analysis utilised a thematic process which allowed the participant’s experiences to determine the emergent themes. The results depicted the diversity of issues that may be raised for dual cultural whānau/family within bereavement processes. Two central themes are discussed in relation to intercultural conflict and the eventual resolution that was created. Decision-making processes, cultural and language differences played significant roles within the conflict and exclusion experienced by the participant. Communication and compromise provided resolution to the prior conflicts experienced. This created positive and unexpected outcomes which resulted in increased understandings and the strengthening of links between the participant, his whānau/family and his wife’s marae.

text: Different coloured tears: Dual cultural identity and Tangihanga Although whānau/family that are configured by both Pākehā and Māori identities number significantly within New Zealand, there has been little or no attention paid to the ways in which these identities influence the bereavement processes that will inevitably impact upon the lives of these whānau/family. The present study explored the experiences of an individual, whose whānau/family included two life ways: Māori and Pākehā. Of specific focus was the ways in which these identities influenced his bereavement subsequent to the death of his beloved wife, who was of Māori descent. One elderly male Pākehā participant was interviewed, using an open ended narrative approach. The interview was semi-structured around five broad themes, but the focus was upon the participant’s experiences and his preference in expressing these. The data analysis utilised a thematic process which allowed the participant’s experiences to determine the emergent themes. The results depicted the diversity of issues that may be raised for dual cultural whānau/family within bereavement processes. Two central themes are discussed in relation to intercultural conflict and the eventual resolution that was created. Decision-making processes, cultural and language differences played significant roles within the conflict and exclusion experienced by the participant. Communication and compromise provided resolution to the prior conflicts experienced. This created positive and unexpected outcomes which resulted in increased understandings and the strengthening of links between the participant, his whānau/family and his wife’s marae.

year: 2011