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dc.contributor.authorBesora, Maria-
dc.date.accessioned2015-07-14T10:53:30Z-
dc.date.available2015-07-14T10:53:30Z-
dc.date.created2015-07-14T12:53:29.067+02:00-
dc.date.issued2015-07-14T12:53:29.067+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/22-
dc.titleP0-
dc.date.updated2015-07-14T10:53:30Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevD.01en
cml.methodRB97Den
cml.basisset6-31g*en
cml.multiplicity1en
cml.spintypeRestricteden
cml.shelltypeCloseden
cml.charge0en
cml.energy.value-40.4888420984en
cml.energy.unitsEhen
cml.formula.genericCH4en
cml.calculationtypeGeometry optimization Minimumen
cml.hassolventtrueen
cml.hasvibrationalfrequenciestrueen
cml.numberofjobs2en
cml.hasmolecularorbitalsfalseen
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