Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone
We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1).
Autor*in: |
---|
Format: |
E-Artikel |
---|---|
Sprache: |
Englisch |
Erschienen: |
1988 |
---|
Reproduktion: |
Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 |
---|---|
Übergeordnetes Werk: |
in: Journal of Molecular Structure: THEOCHEM - Amsterdam : Elsevier, 166(1988), Seite 335-338 |
Übergeordnetes Werk: |
volume:166 ; year:1988 ; pages:335-338 |
Links: |
---|
Katalog-ID: |
NLEJ187951896 |
---|
LEADER | 01000caa a22002652 4500 | ||
---|---|---|---|
001 | NLEJ187951896 | ||
003 | DE-627 | ||
005 | 20210707085800.0 | ||
007 | cr uuu---uuuuu | ||
008 | 070506s1988 xx |||||o 00| ||eng c | ||
035 | |a (DE-627)NLEJ187951896 | ||
035 | |a (DE-599)GBVNLZ187951896 | ||
040 | |a DE-627 |b ger |c DE-627 |e rakwb | ||
041 | |a eng | ||
245 | 1 | 0 | |a Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
264 | 1 | |c 1988 | |
336 | |a nicht spezifiziert |b zzz |2 rdacontent | ||
337 | |a nicht spezifiziert |b z |2 rdamedia | ||
338 | |a nicht spezifiziert |b zu |2 rdacarrier | ||
520 | |a We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). | ||
533 | |f Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 | ||
700 | 1 | |a Pais, A.A.C.C. |4 oth | |
700 | 1 | |a Varandas, A.J.C. |4 oth | |
773 | 0 | 8 | |i in |t Journal of Molecular Structure: THEOCHEM |d Amsterdam : Elsevier |g 166(1988), Seite 335-338 |w (DE-627)NLEJ187913153 |w (DE-600)1491514-5 |x 0166-1280 |7 nnns |
773 | 1 | 8 | |g volume:166 |g year:1988 |g pages:335-338 |
856 | 4 | 0 | |u http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 |
912 | |a GBV_USEFLAG_H | ||
912 | |a ZDB-1-SDJ | ||
912 | |a GBV_NL_ARTICLE | ||
951 | |a AR | ||
952 | |d 166 |j 1988 |h 335-338 |
matchkey_str |
article:01661280:1988----::hrartcefcetfrh1o6281o6ratobsdnsnlvledbptnil |
---|---|
hierarchy_sort_str |
1988 |
publishDate |
1988 |
allfields |
(DE-627)NLEJ187951896 (DE-599)GBVNLZ187951896 DE-627 ger DE-627 rakwb eng Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone 1988 nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 Pais, A.A.C.C. oth Varandas, A.J.C. oth in Journal of Molecular Structure: THEOCHEM Amsterdam : Elsevier 166(1988), Seite 335-338 (DE-627)NLEJ187913153 (DE-600)1491514-5 0166-1280 nnns volume:166 year:1988 pages:335-338 http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 GBV_USEFLAG_H ZDB-1-SDJ GBV_NL_ARTICLE AR 166 1988 335-338 |
spelling |
(DE-627)NLEJ187951896 (DE-599)GBVNLZ187951896 DE-627 ger DE-627 rakwb eng Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone 1988 nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 Pais, A.A.C.C. oth Varandas, A.J.C. oth in Journal of Molecular Structure: THEOCHEM Amsterdam : Elsevier 166(1988), Seite 335-338 (DE-627)NLEJ187913153 (DE-600)1491514-5 0166-1280 nnns volume:166 year:1988 pages:335-338 http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 GBV_USEFLAG_H ZDB-1-SDJ GBV_NL_ARTICLE AR 166 1988 335-338 |
allfields_unstemmed |
(DE-627)NLEJ187951896 (DE-599)GBVNLZ187951896 DE-627 ger DE-627 rakwb eng Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone 1988 nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 Pais, A.A.C.C. oth Varandas, A.J.C. oth in Journal of Molecular Structure: THEOCHEM Amsterdam : Elsevier 166(1988), Seite 335-338 (DE-627)NLEJ187913153 (DE-600)1491514-5 0166-1280 nnns volume:166 year:1988 pages:335-338 http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 GBV_USEFLAG_H ZDB-1-SDJ GBV_NL_ARTICLE AR 166 1988 335-338 |
allfieldsGer |
(DE-627)NLEJ187951896 (DE-599)GBVNLZ187951896 DE-627 ger DE-627 rakwb eng Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone 1988 nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 Pais, A.A.C.C. oth Varandas, A.J.C. oth in Journal of Molecular Structure: THEOCHEM Amsterdam : Elsevier 166(1988), Seite 335-338 (DE-627)NLEJ187913153 (DE-600)1491514-5 0166-1280 nnns volume:166 year:1988 pages:335-338 http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 GBV_USEFLAG_H ZDB-1-SDJ GBV_NL_ARTICLE AR 166 1988 335-338 |
allfieldsSound |
(DE-627)NLEJ187951896 (DE-599)GBVNLZ187951896 DE-627 ger DE-627 rakwb eng Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone 1988 nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 Pais, A.A.C.C. oth Varandas, A.J.C. oth in Journal of Molecular Structure: THEOCHEM Amsterdam : Elsevier 166(1988), Seite 335-338 (DE-627)NLEJ187913153 (DE-600)1491514-5 0166-1280 nnns volume:166 year:1988 pages:335-338 http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 GBV_USEFLAG_H ZDB-1-SDJ GBV_NL_ARTICLE AR 166 1988 335-338 |
language |
English |
source |
in Journal of Molecular Structure: THEOCHEM 166(1988), Seite 335-338 volume:166 year:1988 pages:335-338 |
sourceStr |
in Journal of Molecular Structure: THEOCHEM 166(1988), Seite 335-338 volume:166 year:1988 pages:335-338 |
format_phy_str_mv |
Article |
institution |
findex.gbv.de |
isfreeaccess_bool |
false |
container_title |
Journal of Molecular Structure: THEOCHEM |
authorswithroles_txt_mv |
Pais, A.A.C.C. @@oth@@ Varandas, A.J.C. @@oth@@ |
publishDateDaySort_date |
1988-01-01T00:00:00Z |
hierarchy_top_id |
NLEJ187913153 |
id |
NLEJ187951896 |
language_de |
englisch |
fullrecord_marcxml |
<?xml version="1.0" encoding="UTF-8"?><collection xmlns="http://www.loc.gov/MARC21/slim"><record><leader>01000caa a22002652 4500</leader><controlfield tag="001">NLEJ187951896</controlfield><controlfield tag="003">DE-627</controlfield><controlfield tag="005">20210707085800.0</controlfield><controlfield tag="007">cr uuu---uuuuu</controlfield><controlfield tag="008">070506s1988 xx |||||o 00| ||eng c</controlfield><datafield tag="035" ind1=" " ind2=" "><subfield code="a">(DE-627)NLEJ187951896</subfield></datafield><datafield tag="035" ind1=" " ind2=" "><subfield code="a">(DE-599)GBVNLZ187951896</subfield></datafield><datafield tag="040" ind1=" " ind2=" "><subfield code="a">DE-627</subfield><subfield code="b">ger</subfield><subfield code="c">DE-627</subfield><subfield code="e">rakwb</subfield></datafield><datafield tag="041" ind1=" " ind2=" "><subfield code="a">eng</subfield></datafield><datafield tag="245" ind1="1" ind2="0"><subfield code="a">Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone</subfield></datafield><datafield tag="264" ind1=" " ind2="1"><subfield code="c">1988</subfield></datafield><datafield tag="336" ind1=" " ind2=" "><subfield code="a">nicht spezifiziert</subfield><subfield code="b">zzz</subfield><subfield code="2">rdacontent</subfield></datafield><datafield tag="337" ind1=" " ind2=" "><subfield code="a">nicht spezifiziert</subfield><subfield code="b">z</subfield><subfield code="2">rdamedia</subfield></datafield><datafield tag="338" ind1=" " ind2=" "><subfield code="a">nicht spezifiziert</subfield><subfield code="b">zu</subfield><subfield code="2">rdacarrier</subfield></datafield><datafield tag="520" ind1=" " ind2=" "><subfield code="a">We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1).</subfield></datafield><datafield tag="533" ind1=" " ind2=" "><subfield code="f">Elsevier Journal Backfiles on ScienceDirect 1907 - 2002</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Pais, A.A.C.C.</subfield><subfield code="4">oth</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Varandas, A.J.C.</subfield><subfield code="4">oth</subfield></datafield><datafield tag="773" ind1="0" ind2="8"><subfield code="i">in</subfield><subfield code="t">Journal of Molecular Structure: THEOCHEM</subfield><subfield code="d">Amsterdam : Elsevier</subfield><subfield code="g">166(1988), Seite 335-338</subfield><subfield code="w">(DE-627)NLEJ187913153</subfield><subfield code="w">(DE-600)1491514-5</subfield><subfield code="x">0166-1280</subfield><subfield code="7">nnns</subfield></datafield><datafield tag="773" ind1="1" ind2="8"><subfield code="g">volume:166</subfield><subfield code="g">year:1988</subfield><subfield code="g">pages:335-338</subfield></datafield><datafield tag="856" ind1="4" ind2="0"><subfield code="u">http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">GBV_USEFLAG_H</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">ZDB-1-SDJ</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">GBV_NL_ARTICLE</subfield></datafield><datafield tag="951" ind1=" " ind2=" "><subfield code="a">AR</subfield></datafield><datafield tag="952" ind1=" " ind2=" "><subfield code="d">166</subfield><subfield code="j">1988</subfield><subfield code="h">335-338</subfield></datafield></record></collection>
|
fullrecord |
<?xml version="1.0" encoding="UTF-8"?><collection xmlns="http://www.loc.gov/MARC21/slim"><record><leader>01000caa a22002652 4500</leader><controlfield tag="001">NLEJ187951896</controlfield><controlfield tag="003">DE-627</controlfield><controlfield tag="005">20210707085800.0</controlfield><controlfield tag="007">cr uuu---uuuuu</controlfield><controlfield tag="008">070506s1988 xx |||||o 00| ||eng c</controlfield><datafield tag="035" ind1=" " ind2=" "><subfield code="a">(DE-627)NLEJ187951896</subfield></datafield><datafield tag="035" ind1=" " ind2=" "><subfield code="a">(DE-599)GBVNLZ187951896</subfield></datafield><datafield tag="040" ind1=" " ind2=" "><subfield code="a">DE-627</subfield><subfield code="b">ger</subfield><subfield code="c">DE-627</subfield><subfield code="e">rakwb</subfield></datafield><datafield tag="041" ind1=" " ind2=" "><subfield code="a">eng</subfield></datafield><datafield tag="245" ind1="1" ind2="0"><subfield code="a">Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone</subfield></datafield><datafield tag="264" ind1=" " ind2="1"><subfield code="c">1988</subfield></datafield><datafield tag="336" ind1=" " ind2=" "><subfield code="a">nicht spezifiziert</subfield><subfield code="b">zzz</subfield><subfield code="2">rdacontent</subfield></datafield><datafield tag="337" ind1=" " ind2=" "><subfield code="a">nicht spezifiziert</subfield><subfield code="b">z</subfield><subfield code="2">rdamedia</subfield></datafield><datafield tag="338" ind1=" " ind2=" "><subfield code="a">nicht spezifiziert</subfield><subfield code="b">zu</subfield><subfield code="2">rdacarrier</subfield></datafield><datafield tag="520" ind1=" " ind2=" "><subfield code="a">We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1).</subfield></datafield><datafield tag="533" ind1=" " ind2=" "><subfield code="f">Elsevier Journal Backfiles on ScienceDirect 1907 - 2002</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Pais, A.A.C.C.</subfield><subfield code="4">oth</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Varandas, A.J.C.</subfield><subfield code="4">oth</subfield></datafield><datafield tag="773" ind1="0" ind2="8"><subfield code="i">in</subfield><subfield code="t">Journal of Molecular Structure: THEOCHEM</subfield><subfield code="d">Amsterdam : Elsevier</subfield><subfield code="g">166(1988), Seite 335-338</subfield><subfield code="w">(DE-627)NLEJ187913153</subfield><subfield code="w">(DE-600)1491514-5</subfield><subfield code="x">0166-1280</subfield><subfield code="7">nnns</subfield></datafield><datafield tag="773" ind1="1" ind2="8"><subfield code="g">volume:166</subfield><subfield code="g">year:1988</subfield><subfield code="g">pages:335-338</subfield></datafield><datafield tag="856" ind1="4" ind2="0"><subfield code="u">http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">GBV_USEFLAG_H</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">ZDB-1-SDJ</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">GBV_NL_ARTICLE</subfield></datafield><datafield tag="951" ind1=" " ind2=" "><subfield code="a">AR</subfield></datafield><datafield tag="952" ind1=" " ind2=" "><subfield code="d">166</subfield><subfield code="j">1988</subfield><subfield code="h">335-338</subfield></datafield></record></collection>
|
series2 |
Elsevier Journal Backfiles on ScienceDirect 1907 - 2002 |
ppnlink_with_tag_str_mv |
@@773@@(DE-627)NLEJ187913153 |
format |
electronic Article |
delete_txt_mv |
keep |
collection |
NL |
remote_str |
true |
illustrated |
Not Illustrated |
issn |
0166-1280 |
topic_title |
Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
format_facet |
Elektronische Aufsätze Aufsätze Elektronische Ressource |
format_main_str_mv |
Text Zeitschrift/Artikel |
carriertype_str_mv |
zu |
author2_variant |
a p ap a v av |
hierarchy_parent_title |
Journal of Molecular Structure: THEOCHEM |
hierarchy_parent_id |
NLEJ187913153 |
hierarchy_top_title |
Journal of Molecular Structure: THEOCHEM |
isfreeaccess_txt |
false |
familylinks_str_mv |
(DE-627)NLEJ187913153 (DE-600)1491514-5 |
title |
Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
spellingShingle |
Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
ctrlnum |
(DE-627)NLEJ187951896 (DE-599)GBVNLZ187951896 |
title_full |
Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
journal |
Journal of Molecular Structure: THEOCHEM |
journalStr |
Journal of Molecular Structure: THEOCHEM |
lang_code |
eng |
isOA_bool |
false |
recordtype |
marc |
publishDateSort |
1988 |
contenttype_str_mv |
zzz |
container_start_page |
335 |
container_volume |
166 |
format_se |
Elektronische Aufsätze |
title_sort |
thermal rate coefficients for the ^1^8o+^1^6o"2->^1^8o^1^6o+^1^6o reaction based on a single-valued dmbe potential energy surface for ground-state ozone |
title_auth |
Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
abstract |
We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). |
abstractGer |
We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). |
abstract_unstemmed |
We report quasiclassical trajectory calculations of the thermal rate coefficients for the isotope exchange reaction of ^1^8O with ^1^6O"2 for T=300, 500 and 1000 K on a recently obtained DMBE potential energy surface for O"3 (X^1A"1). |
collection_details |
GBV_USEFLAG_H ZDB-1-SDJ GBV_NL_ARTICLE |
title_short |
Thermal rate coefficients for the ^1^8O+^1^6O"2->^1^8O^1^6O+^1^6O reaction based on a single-valued DMBE potential energy surface for ground-state ozone |
url |
http://linkinghub.elsevier.com/retrieve/pii/0166-1280(88)80458-5 |
remote_bool |
true |
author2 |
Pais, A.A.C.C. Varandas, A.J.C. |
author2Str |
Pais, A.A.C.C. Varandas, A.J.C. |
ppnlink |
NLEJ187913153 |
mediatype_str_mv |
z |
isOA_txt |
false |
hochschulschrift_bool |
false |
author2_role |
oth oth |
up_date |
2024-07-06T10:51:16.587Z |
_version_ |
1803826575841427456 |
score |
7.402793 |