MétaCan
Menu
Back to cohort
Record W1646903801 · doi:10.1063/1.1569907

Isomers of Ge2N2: Production and infrared absorption of GeNNGe in solid N2

2003· article· en· W1646903801 on OpenAlexaff
Mohammed Bahou, K. Sankaran, Yu‐Jong Wu, Yuan‐Pern Lee, D. M. Rayner, Benoît Simard

Bibliographic record

VenueThe Journal of Chemical Physics · 2003
Typearticle
Languageen
FieldMaterials Science
TopicLuminescence Properties of Advanced Materials
Canadian institutionsSteacie Institute for Molecular Sciences
Fundersnot available
KeywordsChemistryMultipletGermaniumInfrared spectroscopyAnalytical Chemistry (journal)Absorption (acoustics)InfraredDensity functional theorySpectral lineAtomic physicsMaterials scienceSiliconComputational chemistryOrganic chemistryOptics

Abstract

fetched live from OpenAlex

Crystalline germanium was ablated with light at 532 nm from a frequency-doubled Nd:YAG laser, and the resultant plume reacted with N2 before deposition onto a substrate at 20 K. Multiple absorption lines at 891.8, 890.8, 890.4, 889.9, 889.4, 888.9, 888.4, 887.9, 887.5, and 887.0 cm−1 that become enhanced after annealing of the matrix at 31 K are attributed to a species containing two Ge atoms in their isotopic variants: Ge70, Ge72, Ge73, Ge74, and Ge76. Replacing N214 with a mixture of N214 and N215 yields an additional multiplet in the region 867.1–862.1 cm−1, whereas reaction of the same mixture subjected to microwave discharge yields a further multiplet in the region 878.9–874.0 cm−1. The isotopic pattern indicates that the vibrational mode is associated with a Ge–N stretching motion that involves two equivalent Ge atoms and two equivalent N atoms. Theoretical calculations with density-functional theories (B3LYP/6-311+G* and B3LYP/aug-cc-pVTZ) predict nine stable isomers of Ge2N2, with linear GeNNGe and asymmetric angular Ge(GeNN) having the least energies. Among calculated vibrational wave numbers, IR intensities, and isotopic shifts for all isomers of Ge2N2, only those predicted for the asymmetric Ge–N stretching mode of linear GeNNGe fit satisfactorily with experimental results. GeNNGe is likely formed from direct reaction of Ge2 and N2 rather than from two-step reactions involving GeNN or GeN.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.009
Threshold uncertainty score0.198

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.016
GPT teacher head0.247
Teacher spread0.231 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations13
Published2003
Admission routes1
Has abstractyes

Explore more

Same venueThe Journal of Chemical PhysicsSame topicLuminescence Properties of Advanced MaterialsFrench-language works237,207