(Q35080599)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

title

First-principles, quantum-mechanical simulations of electron solvation by a water cluster (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

2

Martin Head-Gordon

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

language of work or name

English

0 references

publication date

14 September 2006

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

number of pages

6

1 reference

Proceedings of the National Academy of Sciences of the United States of America

inferred from page(s)

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

volume

103

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

issue

39

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

page(s)

14282-14287

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

Advances in methods and algorithms in a modern quantum chemistry program package.

30 December 2019

cites work

1 reference

PubMed Central

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1599955

Electronic relaxation dynamics of water cluster anions

8 July 2018

1 reference

PubMed Central

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1599955

Hydrated electron dynamics: from clusters to bulk

8 July 2018

1 reference

PubMed Central

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1599955

Observation of large water-cluster anions with surface-bound excess electrons.

8 July 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Identification of two distinct electron binding motifs in the anionic water clusters: a vibrational spectroscopic study of the (H2O)6- isomers.

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Structure of the aqueous solvated electron from resonance Raman spectroscopy: lessons from isotopic mixtures.

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Vibrational predissociation spectroscopy of the (H2O)(6-21)- clusters in the OH stretching region: evolution of the excess electron-binding signature into the intermediate cluster size regime

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Infrared spectroscopy of water cluster anions, (H2O)n=3-24-)in the HOH bending region: persistence of the double H-bond acceptor (AA) water molecule in the excess electron binding site of the class I isomers.

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Electrons in finite-sized water cavities: hydration dynamics observed in real time

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Accelerated, energy-conserving Born-Oppenheimer molecular dynamics via Fock matrix extrapolation

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Calculation of electron detachment energies for water cluster anions: an appraisal of electronic structure methods, with application to (H2O)20- AND (H2O)24-.

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Resonance Raman spectra of electrons solvated in liquid alcohols

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

Damage to model DNA fragments from very low-energy (<1 eV) electrons

21 January 2018

1 reference

https://api.crossref.org/works/10.1073%2FPNAS.0603679103

How do small water clusters bind an excess electron?

21 January 2018

1 reference

12 December 2020

Ammoniated electron as a solvent stabilized multimer radical anion

1 reference

12 December 2020

Quantum Drude oscillator model for describing the interaction of excess electrons with water clusters: an application to (H2O)13(-)

1 reference

12 December 2020

Characterization of excess electrons in water-cluster anions by quantum simulations

1 reference

12 December 2020

Infrared spectrum and structural assignment of the water trimer anion

1 reference

12 December 2020

Theory of dipole-bound anions

1 reference

12 December 2020

Contribution of electron correlation to the stability of dipole-bound anionic states

1 reference

12 December 2020

Identifiers

DOI

10.1073/PNAS.0603679103

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

0 references

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:16973747%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

1 reference