<?xml version="1.0" encoding="UTF-8"?>
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  <title>Browse Collection: Chall_Opp_MLIPs_Het_Cat</title>
  <link rel="alternate" href="https://iochem-bd.iciq.es/browse/handle/100/114360" />
  <subtitle>Chall_Opp_MLIPs_Het_Cat</subtitle>
  <id>https://iochem-bd.iciq.es/browse/handle/100/114360</id>
  <updated>2026-04-07T21:28:49Z</updated>
  <dc:date>2026-04-07T21:28:49Z</dc:date>
  <entry>
    <title>/RPBE/gas-phase    H2O(gas)</title>
    <link rel="alternate" href="https://iochem-bd.iciq.es/browse/handle/100/114477" />
    <author>
      <name>Loveday, Oliver</name>
    </author>
    <id>https://iochem-bd.iciq.es/browse/handle/100/114477</id>
    <updated>2026-02-16T17:05:59Z</updated>
    <published>2026-02-16T17:44:14Z</published>
    <summary type="text">Title: /RPBE/gas-phase    H2O(gas)
Authors: Loveday, Oliver
Abstract: DFT results for gas-phase H2O at RPBE level.</summary>
    <dc:date>2026-02-16T17:44:14Z</dc:date>
  </entry>
  <entry>
    <title>/RPBE/gas-phase    CO(gas)</title>
    <link rel="alternate" href="https://iochem-bd.iciq.es/browse/handle/100/114475" />
    <author>
      <name>Loveday, Oliver</name>
    </author>
    <id>https://iochem-bd.iciq.es/browse/handle/100/114475</id>
    <updated>2026-02-16T17:05:59Z</updated>
    <published>2026-02-16T17:44:14Z</published>
    <summary type="text">Title: /RPBE/gas-phase    CO(gas)
Authors: Loveday, Oliver
Abstract: DFT results for gas-phase CO at RPBE level.</summary>
    <dc:date>2026-02-16T17:44:14Z</dc:date>
  </entry>
  <entry>
    <title>/RPBE/gas-phase    H2(gas)</title>
    <link rel="alternate" href="https://iochem-bd.iciq.es/browse/handle/100/114476" />
    <author>
      <name>Loveday, Oliver</name>
    </author>
    <id>https://iochem-bd.iciq.es/browse/handle/100/114476</id>
    <updated>2026-02-16T17:05:59Z</updated>
    <published>2026-02-16T17:44:14Z</published>
    <summary type="text">Title: /RPBE/gas-phase    H2(gas)
Authors: Loveday, Oliver
Abstract: DFT results for gas-phase H2 at RPBE level.</summary>
    <dc:date>2026-02-16T17:44:14Z</dc:date>
  </entry>
  <entry>
    <title>/RPBE/gas-phase    CO2(gas)</title>
    <link rel="alternate" href="https://iochem-bd.iciq.es/browse/handle/100/114474" />
    <author>
      <name>Loveday, Oliver</name>
    </author>
    <id>https://iochem-bd.iciq.es/browse/handle/100/114474</id>
    <updated>2026-02-16T17:05:59Z</updated>
    <published>2026-02-16T17:44:14Z</published>
    <summary type="text">Title: /RPBE/gas-phase    CO2(gas)
Authors: Loveday, Oliver
Abstract: DFT results for gas-phase CO2 at RPBE level.</summary>
    <dc:date>2026-02-16T17:44:14Z</dc:date>
  </entry>
</feed>

